Chemical Properties of 3-Pentanone (CAS 96-22-0)

InChI

InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3

InChI Key

FDPIMTJIUBPUKL-UHFFFAOYSA-N

Formula

C5H10O

SMILES

CCC(=O)CC

Molecular Weight¹

86.13

CAS

96-22-0

Other Names

• (C2H5)2CO
• 1,3-Dimethylacetone
• DEK
• Diethylcetone
• Dimethylacetone
• Ethyl ketone
• Ethyl propionyl
• Metacetone
• Methacetone
• NSC 8653
• Pentanone-3
• Propione
• UN 1156
• diethyl ketone
• pentan-3-one

• ω : Acentric Factor.
• PAff : Proton affinity (kJ/mol).
• BasG : Gas basicity (kJ/mol).
• Δ_cH°_liquid : Standard liquid enthalpy of combustion (kJ/mol).
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• C_p,liquid : Liquid phase heat capacity (J/mol×K).
• μ : Dipole Moment (debye).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_fH°_gas : Enthalpy of formation at standard conditions (kJ/mol).
• Δ_fH°_liquid : Liquid phase enthalpy of formation at standard conditions (kJ/mol).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_fusH : Enthalpy of fusion at a given temperature (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• IE : Ionization energy (eV).
• log₁₀WS : Log10 of Water solubility in mol/l.
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• NFPA Fire : NFPA Fire Rating.
• NFPA Health : NFPA Health Rating.
• P_c : Critical Pressure (kPa).
• P_vap : Vapor pressure (kPa).
• n₀ : Refractive Index.
• ρ_c : Critical density (kg/m³).
• ρ_l : Liquid Density (kg/m³).
• I_np : Non-polar retention indices.
• I : Polar retention indices.
• Δ_fusS : Entropy of fusion at a given temperature (J/mol×K).
• S°_liquid : Liquid phase molar entropy at standard conditions (J/mol×K).
• c_sound,fluid : Speed of sound in fluid (m/s).
• γ : Surface Tension (N/m).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ω	0.3440		KDB
PAff	836.80	kJ/mol	NIST
BasG	[802.60; 807.00]	kJ/mol
BasG	807.00	kJ/mol	NIST
BasG	803.80 ± 0.30	kJ/mol	NIST
BasG	802.60	kJ/mol	NIST
ΔcH°liquid	[-3104.70; -3100.20]	kJ/mol
ΔcH°liquid	-3104.70 ± 0.90	kJ/mol	NIST
ΔcH°liquid	-3100.20 ± 1.00	kJ/mol	NIST
μ	2.70	debye	KDB
ΔfG°	-135.40	kJ/mol	KDB
ΔfH°gas	[-260.50; -253.40]	kJ/mol
ΔfH°gas	-258.80	kJ/mol	KDB
ΔfH°gas	-253.40 ± 0.90	kJ/mol	NIST
ΔfH°gas	-257.95 ± 0.84	kJ/mol	NIST
ΔfH°gas	-260.50 ± 1.60	kJ/mol	NIST
ΔfH°liquid	-296.51 ± 0.83	kJ/mol	NIST
ΔfusH°	10.30	kJ/mol	Joback Calculated Property
ΔvapH°	[38.50; 38.70]	kJ/mol
ΔvapH°	38.68	kJ/mol	NIST
ΔvapH°	38.52	kJ/mol	NIST
ΔvapH°	38.50	kJ/mol	NIST
ΔvapH°	38.70 ± 0.30	kJ/mol	NIST
ΔvapH°	38.60	kJ/mol	NIST
IE	[9.22; 9.37]	eV
IE	9.31 ± 0.02	eV	NIST
IE	9.31	eV	NIST
IE	9.30	eV	NIST
IE	Outlier 9.22 ± 0.02	eV	NIST
IE	9.31 ± 0.01	eV	NIST
IE	9.31 ± 0.01	eV	NIST
IE	9.37 ± 0.03	eV	NIST
IE	9.31 ± 0.02	eV	NIST
IE	9.32 ± 0.01	eV	NIST
log10WS	[-0.28; -0.28]
log10WS	-0.28		Aq. Solubility Prediction
log10WS	-0.28		Estimated Solubility
logPoct/wat	1.375		Crippen Calculated Property
McVol	82.880	ml/mol	McGowan Calculated Property
NFPA Fire	3		KDB
NFPA Health	1		KDB
Pc	[3729.00; 3740.00]	kPa
Pc	3729.00	kPa	KDB
Pc	3729.00 ± 10.00	kPa	NIST
Pc	3740.00 ± 41.40	kPa	NIST
ρc	255.81 ± 30.15	kg/m3	NIST
Inp	[638.00; 707.00]
Inp	676.40		NIST
Inp	676.91		NIST
Inp	675.75		NIST
Inp	675.42		NIST
Inp	675.52		NIST
Inp	675.84		NIST
Inp	677.74		NIST
Inp	677.00		NIST
Inp	675.00		NIST
Inp	676.00		NIST
Inp	676.00		NIST
Inp	682.00		NIST
Inp	681.00		NIST
Inp	682.00		NIST
Inp	682.00		NIST
Inp	Outlier 640.00		NIST
Inp	658.00		NIST
Inp	665.00		NIST
Inp	651.00		NIST
Inp	Outlier 638.00		NIST
Inp	647.00		NIST
Inp	651.00		NIST
Inp	647.00		NIST
Inp	672.00		NIST
Inp	700.00		NIST
Inp	651.00		NIST
Inp	651.00		NIST
Inp	670.00		NIST
Inp	659.00		NIST
Inp	651.00		NIST
Inp	703.00		NIST
Inp	707.00		NIST
Inp	694.00		NIST
Inp	703.00		NIST
Inp	675.00		NIST
Inp	665.00		NIST
Inp	672.00		NIST
Inp	689.00		NIST
Inp	697.00		NIST
Inp	687.00		NIST
Inp	697.00		NIST
Inp	675.00		NIST
Inp	700.00		NIST
Inp	701.30		NIST
Inp	671.00		NIST
Inp	669.00		NIST
Inp	669.00		NIST
Inp	675.00		NIST
Inp	669.92		NIST
Inp	701.00		NIST
Inp	681.00		NIST
Inp	669.00		NIST
Inp	688.00		NIST
Inp	685.00		NIST
Inp	651.00		NIST
Inp	676.00		NIST
Inp	650.00		NIST
Inp	677.00		NIST
Inp	705.00		NIST
Inp	675.00		NIST
Inp	681.00		NIST
Inp	688.00		NIST
Inp	675.00		NIST
Inp	676.00		NIST
Inp	678.00		NIST
Inp	678.00		NIST
Inp	683.00		NIST
Inp	666.00		NIST
Inp	669.00		NIST
Inp	685.00		NIST
Inp	683.00		NIST
Inp	643.00		NIST
Inp	672.00		NIST
Inp	675.00		NIST
Inp	703.00		NIST
I	[956.00; 1011.30]
I	Outlier 1011.30		NIST
I	996.90		NIST
I	1001.50		NIST
I	Outlier 1006.30		NIST
I	974.00		NIST
I	976.00		NIST
I	958.00		NIST
I	983.00		NIST
I	983.00		NIST
I	983.00		NIST
I	978.00		NIST
I	977.00		NIST
I	970.00		NIST
I	956.00		NIST
I	979.00		NIST
I	979.00		NIST
I	970.00		NIST
I	981.00		NIST
I	975.00		NIST
I	964.00		NIST
I	980.00		NIST
I	971.00		NIST
I	969.00		NIST
I	1002.00		NIST
I	983.00		NIST
I	980.00		NIST
I	997.00		NIST
I	980.00		NIST
I	986.00		NIST
I	965.00		NIST
I	977.00		NIST
I	981.00		NIST
I	965.00		NIST
I	977.00		NIST
I	970.00		NIST
I	971.00		NIST
I	969.00		NIST
I	980.00		NIST
I	965.00		NIST
S°liquid	266.00	J/mol×K	NIST
Tboil	[372.65; 376.65]	K
Tboil	375.11	K	KDB
Tboil	375.40 ± 0.30	K	NIST
Tboil	374.70	K	NIST
Tboil	375.00 ± 0.30	K	NIST
Tboil	375.20	K	NIST
Tboil	375.00 ± 0.40	K	NIST
Tboil	374.90 ± 0.30	K	NIST
Tboil	375.00 ± 0.40	K	NIST
Tboil	375.00 ± 0.50	K	NIST
Tboil	Outlier 372.65 ± 2.00	K	NIST
Tboil	374.85 ± 1.00	K	NIST
Tboil	Outlier 373.65 ± 5.00	K	NIST
Tboil	375.30 ± 0.50	K	NIST
Tboil	374.65 ± 1.50	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	375.95 ± 1.00	K	NIST
Tboil	375.05 ± 0.30	K	NIST
Tboil	374.15 ± 1.50	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	374.85 ± 0.20	K	NIST
Tboil	375.20 ± 0.50	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	375.20 ± 0.50	K	NIST
Tboil	373.90 ± 2.00	K	NIST
Tboil	374.65 ± 0.50	K	NIST
Tboil	374.15 ± 2.00	K	NIST
Tboil	374.90 ± 0.30	K	NIST
Tboil	375.15 ± 2.00	K	NIST
Tboil	375.15 ± 0.50	K	NIST
Tboil	Outlier 376.65 ± 3.00	K	NIST
Tboil	375.95 ± 1.00	K	NIST
Tboil	374.80 ± 0.30	K	NIST
Tboil	375.65 ± 1.00	K	NIST
Tboil	374.85 ± 0.30	K	NIST
Tboil	374.88 ± 0.30	K	NIST
Tboil	375.15 ± 0.20	K	NIST
Tboil	375.65 ± 2.00	K	NIST
Tboil	375.35 ± 2.00	K	NIST
Tboil	374.90 ± 0.50	K	NIST
Tboil	374.20 ± 0.50	K	NIST
Tboil	374.90 ± 0.50	K	NIST
Tboil	376.15 ± 1.00	K	NIST
Tboil	374.85 ± 0.30	K	NIST
Tboil	374.40 ± 0.50	K	NIST
Tboil	374.25 ± 1.00	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	374.15 ± 1.00	K	NIST
Tboil	376.15 ± 1.00	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tboil	374.95 ± 1.00	K	NIST
Tboil	375.85 ± 1.00	K	NIST
Tboil	374.65 ± 1.00	K	NIST
Tboil	375.15 ± 1.00	K	NIST
Tc	[560.90; 561.50]	K
Tc	561.46	K	KDB
Tc	561.50	K	NIST
Tc	561.46 ± 0.20	K	NIST
Tc	560.90 ± 0.56	K	NIST
Tfus	[231.15; 234.18]	K
Tfus	234.00	K	KDB
Tfus	233.90	K	Aq. Solubility Prediction
Tfus	234.15 ± 0.02	K	NIST
Tfus	234.18 ± 0.01	K	NIST
Tfus	233.35 ± 0.40	K	NIST
Tfus	231.20 ± 1.50	K	NIST
Tfus	231.15 ± 0.50	K	NIST
Ttriple	[234.16; 234.36]	K
Ttriple	234.36	K	Thermodynamics of binary mixtures of N-methyl-2-pyrrolidinone and ketone. Experimental results and modelling of the solid-liquid equilibrium and vapou-liquid equilibrium. The Modified UNIFAC (Do) model characterization
Ttriple	234.16 ± 0.03	K	NIST
Ttriple	234.16 ± 0.03	K	NIST
Vc	0.336	m3/kmol	KDB
Zc	0.2683960		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[146.31; 175.14]	J/mol×K	[364.15; 473.15]
Cp,gas	146.31	J/mol×K	364.15	NIST
Cp,gas	151.38	J/mol×K	383.15	NIST
Cp,gas	156.77	J/mol×K	403.15	NIST
Cp,gas	162.13	J/mol×K	423.15	NIST
Cp,gas	168.70	J/mol×K	448.15	NIST
Cp,gas	175.14	J/mol×K	473.15	NIST
Cp,liquid	[190.00; 200.70]	J/mol×K	[298.15; 298.15]
Cp,liquid	196.40	J/mol×K	298.15	NIST
Cp,liquid	195.70	J/mol×K	298.15	NIST
Cp,liquid	190.30	J/mol×K	298.15	NIST
Cp,liquid	190.00	J/mol×K	298.15	NIST
Cp,liquid	200.70	J/mol×K	298.15	NIST
Cp,liquid	190.90	J/mol×K	298.15	NIST
η	[0.0003760; 0.0004714]	Pa×s	[293.15; 313.15]
η	0.0004714	Pa×s	293.15	Viscosities, Densities, and Ultrasonic Velocities of 3-Pentanone + Ethylbenzene and 3-Pentanone + o-Xylene at (293.15, 303.15, and 313.15) K
η	0.0004490	Pa×s	298.15	Density and Viscosity of Binary Mixtures of n-Butyl Acetate with Ketones at (298.15, 303.15, 308.15, and 313.15) K
η	0.0004231	Pa×s	303.15	Viscosities, Densities, and Ultrasonic Velocities of 3-Pentanone + Ethylbenzene and 3-Pentanone + o-Xylene at (293.15, 303.15, and 313.15) K
η	0.0004290	Pa×s	303.15	Densities, Viscosities, and Refractive Indices of Binary Mixtures of Diethyl Oxalate with Some Ketones at (303.15, 308.15, and 313.15) K
η	0.0004190	Pa×s	303.15	Density and Viscosity of Binary Mixtures of n-Butyl Acetate with Ketones at (298.15, 303.15, 308.15, and 313.15) K
η	0.0003970	Pa×s	308.15	Densities, Viscosities, and Refractive Indices of Binary Mixtures of Diethyl Oxalate with Some Ketones at (303.15, 308.15, and 313.15) K
η	0.0003960	Pa×s	308.15	Density and Viscosity of Binary Mixtures of n-Butyl Acetate with Ketones at (298.15, 303.15, 308.15, and 313.15) K
η	0.0003799	Pa×s	313.15	Viscosities, Densities, and Ultrasonic Velocities of 3-Pentanone + Ethylbenzene and 3-Pentanone + o-Xylene at (293.15, 303.15, and 313.15) K
η	0.0003880	Pa×s	313.15	Densities, Viscosities, and Refractive Indices of Binary Mixtures of Diethyl Oxalate with Some Ketones at (303.15, 308.15, and 313.15) K
η	0.0003760	Pa×s	313.15	Density and Viscosity of Binary Mixtures of n-Butyl Acetate with Ketones at (298.15, 303.15, 308.15, and 313.15) K
ΔfusH	[0.01; 11.59]	kJ/mol	[118.50; 234.20]
ΔfusH	0.11	kJ/mol	118.50	NIST
ΔfusH	0.01	kJ/mol	180.00	NIST
ΔfusH	11.59	kJ/mol	234.20	NIST
ΔfusH	11.59	kJ/mol	234.20	NIST
ΔvapH	[33.30; 36.90]	kJ/mol	[303.00; 527.50]
ΔvapH	36.90	kJ/mol	303.00	NIST
ΔvapH	35.90 ± 0.20	kJ/mol	332.50	NIST
ΔvapH	36.10 ± 0.10	kJ/mol	335.00	NIST
ΔvapH	34.90 ± 0.10	kJ/mol	354.00	NIST
ΔvapH	36.60	kJ/mol	356.50	NIST
ΔvapH	33.50 ± 0.10	kJ/mol	375.00	NIST
ΔvapH	33.45	kJ/mol	375.20	NIST
ΔvapH	36.60	kJ/mol	377.50	NIST
ΔvapH	33.70	kJ/mol	461.50	NIST
ΔvapH	33.30	kJ/mol	527.50	NIST
n0	[1.39000; 1.39020]		[298.15; 298.15]
n0	1.39020		298.15	Excess molar volumes and ultrasonic studies of N-methyl-2-pyrrolidone with ketones at T = 303.15 K
n0	1.39000		298.15	Phase Equilibria in the Binary and Ternary Systems Composed of Diethyl ketone, 2-Pentanone and 3-Pentanol at 101.3 kPa
ρl	[789.41; 818.90]	kg/m3	[288.15; 318.15]
ρl	818.90	kg/m3	288.15	Thermal and Volumetric Properties of Some C5 and C6 Alkanones at Infinite Dilution in Water
ρl	814.00	kg/m3	293.00	KDB
ρl	809.09	kg/m3	298.15	Excess molar enthalpies and volumes of binary mixtures of nonafluorobutylmethylether with ketones at T = 298.15 K
ρl	809.38	kg/m3	298.15	Excess molar volumes, viscosity deviations and excess thermal expansion coefficients for binary and ternary mixtures consist of diethylketone + 2-butanol + ethylchloroacetate at (298.15, 308.15 and 318.15) K
ρl	809.16	kg/m3	298.15	Thermal and Volumetric Properties of Some C5 and C6 Alkanones at Infinite Dilution in Water
ρl	804.62	kg/m3	303.15	Excess molar volumes and ultrasonic studies of dimethylsulphoxide with ketones at T = 303.15 K
ρl	799.55	kg/m3	308.15	Excess molar volumes, viscosity deviations and excess thermal expansion coefficients for binary and ternary mixtures consist of diethylketone + 2-butanol + ethylchloroacetate at (298.15, 308.15 and 318.15) K
ρl	799.32	kg/m3	308.15	Thermal and Volumetric Properties of Some C5 and C6 Alkanones at Infinite Dilution in Water
ρl	789.63	kg/m3	318.15	Excess molar volumes, viscosity deviations and excess thermal expansion coefficients for binary and ternary mixtures consist of diethylketone + 2-butanol + ethylchloroacetate at (298.15, 308.15 and 318.15) K
ρl	789.41	kg/m3	318.15	Thermal and Volumetric Properties of Some C5 and C6 Alkanones at Infinite Dilution in Water
ΔfusS	[0.04; 49.50]	J/mol×K	[118.50; 234.20]
ΔfusS	0.96	J/mol×K	118.50	NIST
ΔfusS	0.04	J/mol×K	180.00	NIST
ΔfusS	49.50	J/mol×K	234.20	NIST
csound,fluid	[1160.00; 1197.00]	m/s	[303.15; 313.15]
csound,fluid	1197.00	m/s	303.15	Densities and Speeds of Sound for Binary Liquid Mixtures of Thiolane-l,l-dioxide with Butanone, Pentan-2-one, Pentan-3-one, and 4-Methyl-pentan-2-one at T = (303.15 or 308.15 or 313.15) K
csound,fluid	1179.00	m/s	308.15	Densities and Speeds of Sound for Binary Liquid Mixtures of Thiolane-l,l-dioxide with Butanone, Pentan-2-one, Pentan-3-one, and 4-Methyl-pentan-2-one at T = (303.15 or 308.15 or 313.15) K
csound,fluid	1160.00	m/s	313.15	Densities and Speeds of Sound for Binary Liquid Mixtures of Thiolane-l,l-dioxide with Butanone, Pentan-2-one, Pentan-3-one, and 4-Methyl-pentan-2-one at T = (303.15 or 308.15 or 313.15) K
γ	[0.02; 0.03]	N/m	[283.15; 329.15]
γ	0.03	N/m	283.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	285.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	287.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	289.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	291.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	293.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	295.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	297.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.03	N/m	299.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	301.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	303.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	305.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	307.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	309.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	311.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	313.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	315.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	317.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	319.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	321.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	323.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	325.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	327.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
γ	0.02	N/m	329.15	Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K

Datasets

Viscosity, Pa*s

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Viscosity, Pa*s - Liquid
308.15	101.30	0.0004
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[274.94; 399.57]	The Yaws Handbook of Vapor Pressure
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.47173e+01
Coefficient B			-3.36681e+03
Coefficient C			-4.16190e+01
Temperature range, min.			274.94
Temperature range, max.			399.57
Pvap	1.33	kPa	274.94	Calculated Property
Pvap	2.99	kPa	288.79	Calculated Property
Pvap	6.16	kPa	302.64	Calculated Property
Pvap	11.80	kPa	316.48	Calculated Property
Pvap	21.24	kPa	330.33	Calculated Property
Pvap	36.22	kPa	344.18	Calculated Property
Pvap	58.94	kPa	358.03	Calculated Property
Pvap	92.09	kPa	371.87	Calculated Property
Pvap	138.80	kPa	385.72	Calculated Property
Pvap	202.66	kPa	399.57	Calculated Property
Pvap	[0.06; 3708.73]	kPa	[234.18; 561.00]	KDB Vapor Pressure Data
Equation			ln(Y) = A + B/T + C·ln(T) + D·T² + E/T² Y is Pvap in kPa, T in K
Coefficient A			7.00329e+01
Coefficient B			-6.68960e+03
Coefficient C			-8.16282e+00
Coefficient D			5.65048e-06
Coefficient E			0.00000e+00
Temperature range, min.			234.18
Temperature range, max.			561.00
Pvap	0.06	kPa	234.18	Calculated Property
Pvap	1.00	kPa	270.49	Calculated Property
Pvap	7.53	kPa	306.81	Calculated Property
Pvap	34.69	kPa	343.12	Calculated Property
Pvap	114.38	kPa	379.43	Calculated Property
Pvap	297.85	kPa	415.75	Calculated Property
Pvap	654.34	kPa	452.06	Calculated Property
Pvap	1269.29	kPa	488.37	Calculated Property
Pvap	2245.41	kPa	524.69	Calculated Property
Pvap	3708.73	kPa	561.00	Calculated Property
Pvap	[20.44; 133.43]	kPa	[329.69; 384.50]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.41590e+01
Coefficient B			-3.01559e+03
Coefficient C			-5.90320e+01
Reference			Collerson, Counsell, et al., 1965, 2
Temperature range, min.			329.69
Temperature range, max.			384.50
Pvap	20.44	kPa	329.69	Calculated Property
Pvap	26.11	kPa	335.78	Calculated Property
Pvap	33.02	kPa	341.87	Calculated Property
Pvap	41.34	kPa	347.96	Calculated Property
Pvap	51.28	kPa	354.05	Calculated Property
Pvap	63.06	kPa	360.14	Calculated Property
Pvap	76.90	kPa	366.23	Calculated Property
Pvap	93.07	kPa	372.32	Calculated Property
Pvap	111.82	kPa	378.41	Calculated Property
Pvap	133.43	kPa	384.50	Calculated Property
Pvap	[9.19; 97.09]	kPa	[309.51; 374.80]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.12030e+01
Coefficient B			-1.64904e+03
Coefficient C			-1.25978e+02
Reference			Dreisbach and Shrader, 1949
Temperature range, min.			309.51
Temperature range, max.			374.80
Pvap	9.19	kPa	309.51	Calculated Property
Pvap	12.93	kPa	316.76	Calculated Property
Pvap	17.75	kPa	324.02	Calculated Property
Pvap	23.82	kPa	331.27	Calculated Property
Pvap	31.33	kPa	338.53	Calculated Property
Pvap	40.48	kPa	345.78	Calculated Property
Pvap	51.44	kPa	353.04	Calculated Property
Pvap	64.41	kPa	360.29	Calculated Property
Pvap	79.57	kPa	367.55	Calculated Property
Pvap	97.09	kPa	374.80	Calculated Property
Pvap	[20.44; 133.43]	kPa	[329.69; 384.50]	NIST
Equation			ln(Y) = A + B/(T + C) Y is Pvap in kPa, T in K
Coefficient A			1.41590e+01
Coefficient B			-3.01559e+03
Coefficient C			-5.90320e+01
Reference			Collerson, Counsell, et al., 1965
Temperature range, min.			329.69
Temperature range, max.			384.50
Pvap	20.44	kPa	329.69	Calculated Property
Pvap	26.11	kPa	335.78	Calculated Property
Pvap	33.02	kPa	341.87	Calculated Property
Pvap	41.34	kPa	347.96	Calculated Property
Pvap	51.28	kPa	354.05	Calculated Property
Pvap	63.06	kPa	360.14	Calculated Property
Pvap	76.90	kPa	366.23	Calculated Property
Pvap	93.07	kPa	372.32	Calculated Property
Pvap	111.82	kPa	378.41	Calculated Property
Pvap	133.43	kPa	384.50	Calculated Property

Similar Compounds

Find more compounds similar to 3-Pentanone.

Mixtures

• Acetic acid, chloro-, ethyl ester + 3-Pentanone
• 3-Pentanone + Dodecanedioic acid
• 3-Pentanone + Dimethyl Sulfoxide
• 3-Pentanone + 2-Pyrrolidinone, 1-methyl-
• 3-Pentanone + Acetic acid, butyl ester
• 3-Pentanone + Water
• 3-Pentanone + 1-Octanol
• 3-Pentanone + Thiophene, tetrahydro-, 1,1-dioxide
• Ethanedioic acid, diethyl ester + 3-Pentanone
• 3-Pentanone + N^1,n^3 dibutylimidazolidine 2-thione
• 3-Pentanone + Benzene, ethyl-
• 3-Pentanone + o-Xylene
• 3-Pentanone + Benzyl nitrile
• 2-Pentanone + 3-Pentanone
• 3-Pentanone + 3-Pentanol
• 2-Pentanone + 3-Pentanone + 3-Pentanol

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Measurement of vapor.liquid equilibria (VLE) and excess enthalpies (HE) of binary systems with 1-alkyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide and prediction of these properties and A using modified UNIFAC (Dortmund)
• Experimental and theoretical study of interaction between organic compounds and 1- (4-sulfobutyl)-3-methylimidazolium based ionic liquids
• Study of interaction between organic compounds and mono or dicationic oxygenated ionic liquids using gas chromatography
• Activity coefficients at infinite dilution of organic solvents and water in 1-butyl-3-methylimidazolium dicyanamide. A literature review of hexane/hex-1-ene separation
• High selective water/butan-1-ol separation on investigation of limiting activity coefficients with [P8,8,8,8][[NTf2] ionic liquid
• Separation of binary mixtures based on limiting activity coefficients data using specific ammonium-based ionic liquid and modelling of thermodynamic functions
• Thermodynamics and activity coefficients at infinite dilution for organic solutes in the ionic liquid 1-butyl-1-methylpyrrolidinium dicyanamide
• New ionic liquid [P4,4,4,4][NTf2] in bio-butanol extraction on investigation of limiting activity coefficients
• Ammonium ionic liquids in extraction of bio-butan-1-ol from water phase using activity coefficients at infinite dilution
• Thermodynamics of binary mixtures of N-methyl-2-pyrrolidinone and ketone. Experimental results and modelling of the solid-liquid equilibrium and vapou-liquid equilibrium. The Modified UNIFAC (Do) model characterization
• (Liquid + liquid) phase equilibria of 1-alkyl-3-methylimidazolium methylsulfate with alcohols, or ethers, or ketones
• Excess molar enthalpies and volumes of binary mixtures of nonafluorobutylmethylether with ketones at T = 298.15 K
• Thermodynamic investigation of methyl salicylate/1-pentanol binary system in the temperature range from 278.15 K to 303.15 K
• Partial molar volumes of organic solutes in water. XVII: 3-Pentanone(aq) and 2,4-pentanedione(aq) at T = (298 to 573) K and at pressures up to 30 MPa
• Excess molar volumes and ultrasonic studies of dimethylsulphoxide with ketones at T = 303.15 K
• Excess molar volumes and ultrasonic studies of N-methyl-2-pyrrolidone with ketones at T = 303.15 K
• Measurements of activity coefficients at infinite dilution of organic solutes and water in 1-propyl-1-methylpiperidinium bis{(trifluoromethyl)sulfonyl}imide ionic liquid using g.l.c.
• Measurements of activity coefficients at infinite dilution of organic compounds and water in isoquinolinium-based ionic liquid [C8iQuin][NTf2] using GLC
• Activity coefficients at infinite dilution measurements for organic solutes and water in the ionic liquid 1-ethyl-3-methylimidazolium tetracyanoborate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(3-hydroxypropyl)pyridinium bis(trifluoromethylsulfonyl)-amide
• Thermodynamics and activity coefficients at infinite dilution measurements for organic solutes and water in the ionic liquid 1-butyl-1-methylpyrrolidinium tetracyanoborate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(2-methoxyethyl)-4-methylmorpholinium bis(trifluoromethylsulfonyl)-amide
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-hexyl-3-methylimidazolium tetracyanoborate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)-1-methylpiperidinium bis(trifluoromethylsulfonyl)-amide
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-ethyl-3-methylimidazolium methanesulfonate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)-1-methylpyrrolidinium bis(trifluoromethylsulfonyl)-amide
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(2-methoxyethyl)-4-methylmorpholinium trifluorotris(perfluoroethyl)phosphate
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)- 1-methylpiperidinium trifluorotris(perfluoroethyl)phosphate
• Physicochemical properties and activity coefficients at infinite dilution for organic solutes and water in a novel bicyclic guanidinium superbase-derived protic ionic liquid
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-methoxyethyl)- 1-methylpyrrolidinium trifluorotris(perfluoroethyl)phosphate
• Measurements of activity coefficients at infinite dilution for organic solutes and water in N-hexylisoquinolinium thiocyanate, [HiQuin][SCN] using GLC
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 1-(2-hydroxyethyl)- 3-methylimidazolium trifluorotris(perfluoroethyl)phosphate
• Measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-butyl-1-methylpyrrolidinium tricyanomethanide
• Thermodynamics and activity coefficients at infinite dilution for organic solutes and water in the ionic liquid 1-butyl-1-methylmorpholinium tricyanomethanide
• The study of activity coefficients at infinite dilution for organic solutes and water in 1-butyl-4-methylpyridinium dicyanamide, [B4MPy][DCA] using GLC
• Measurement and correlation of solubility of dodecanedioic acid in different pure solvents from T = (288.15 to 323.15) K
• Measurement of activity coefficients at infinite dilution of organic solutes in the ionic liquid 1-hexyl-1,4-diaza[2.2.2]bicyclooctanium bis(trifluoromethylsulfonyl)imide using gas-liquid chromatography
• Thermodynamics and activity coefficients at infinite dilution for organic solutes, water and diols in the ionic liquid choline bis(trifluoromethylsulfonyl)imide
• Experimental and theoretically study of interaction between organic compounds and tricyanomethanide based ionic liquids
• Activity coefficients at infinite dilution of organic solutes in methylphosphonate based ionic liquids using gas-liquid chromatography
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid 4-(3-hydroxypropyl)-4-methylmorpholinium bis(trifluoromethylsulfonyl)-amide
• Activity coefficients at infinite dilution for organic solutes and water in 1-ethyl-1-methylpyrrolidinium lactate
• Activity coefficients at infinite dilution, physicochemical and thermodynamic properties for organic solutes and water in the ionic liquid ethyl-dimethyl-(2-methoxyethyl)ammonium trifluorotris-(perfluoroethyl)phosphate
• A 1-alkylcyanopyridinium-based ionic liquid in the separation processes
• Thermodynamics and selectivity of separation based on activity coefficients at infinite dilution of various solutes in 1-allyl-3-methylimidazolium bis{(trifluoromethyl)sulfonyl}imide ionic liquid
• Separation of aliphatic from aromatic hydrocarbons and sulphur compounds from fuel based on measurements of activity coefficients at infinite dilution for organic solutes and water in the ionic liquid N,N-diethyl-N-methyl-N-(2-methoxy-ethyl)ammonium bis(trifluoromethylsulfonyl)imide
• Thermodynamics and limiting activity coefficients measurements for organic solutes and water in the ionic liquid 1-dodecyl-3-methylimidzolium bis(trifluoromethylsulfonyl) imide
• Solubility measurement, model evaluation and thermodynamic analysis of rivaroxaban polymorphs in organic solvents
• Separation of binary mixtures hexane/hex-1-ene, cyclohexane/cyclohexene and ethylbenzene/styrene based on limiting activity coefficients
• Separation of water/butan-1-ol based on activity coefficients at infinite dilution in 1,3-didecyl-2-methylimidazolium dicyanamide ionic liquid
• Separation of binary mixtures hexane/hex-1-ene, cyclohexane/cyclohexene and ethylbenzene/styrene based on gamma infinity data measurements
• Activity coefficients at infinite dilution and physicochemical properties for organic solutes and water in the ionic liquid trihexyl-tetradecyl-phosphonium tricyanomethanide
• Thermodynamic study of molecular interaction-selectivity in separation processes based on limiting activity coefficients
• The use of ionic liquids for separation of binary hydrocarbons mixtures based on gamma infinity data measurements
• Excess molar volumes, viscosity deviations and excess thermal expansion coefficients for binary and ternary mixtures consist of diethylketone + 2-butanol + ethylchloroacetate at (298.15, 308.15 and 318.15) K
• Activity Coefficients at Infinite Dilution of Organic Solutes and Water in Tributylethylphosphonium Diethylphosphate Using Gas Liquid Chromatography: Thermodynamic Properties of Mixtures Containing Ionic Liquids
• Thermal and Volumetric Properties of Some C5 and C6 Alkanones at Infinite Dilution in Water
• Air-Water Partitioning of C5 and C6 Alkanones: Measurement, Critical Compilation, Correlation, and Recommended Data
• Phase Equilibria in the Binary and Ternary Systems Composed of Diethyl ketone, 2-Pentanone and 3-Pentanol at 101.3 kPa
• Viscosities, Densities, and Ultrasonic Velocities of 3-Pentanone + Ethylbenzene and 3-Pentanone + o-Xylene at (293.15, 303.15, and 313.15) K
• Activity Coefficients at Infinite Dilution Measurements for Organic Solutes and Water in the Ionic Liquid 1-Butyl-3-methyl-pyridinium Trifluoromethanesulfonate
• Determination of Activity Coefficients at Infinite Dilution of 35 Solutes in the Ionic Liquid, 1-Butyl-3-methylimidazolium Tosylate, Using Gas-Liquid Chromatography
• Densities, Viscosities, and Refractive Indices of Binary Mixtures of Diethyl Oxalate with Some Ketones at (303.15, 308.15, and 313.15) K
• Measurements of Activity Coefficients at Infinite Dilution for Organic Solutes and Water in the Ionic Liquid 1-Butyl-1-methylpiperydinium Thiocyanate
• Activity Coefficients at Infinite Dilution of Organic Compounds in Four New Imidazolium-Based Ionic Liquids
• Partition Coefficients of Organic Compounds in Four New Tetraalkylammonium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Using Inverse Gas Chromatography
• Evaluation of the Performance of Trigeminal Tricationic Ionic Liquids for Separation Problems
• Density and Viscosity of Binary Mixtures of n-Butyl Acetate with Ketones at (298.15, 303.15, 308.15, and 313.15) K
• Activity Coefficients at Infinite Dilution for Organic Compounds Dissolved in 1-Alkyl-1-methylpyrrolidinium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Having Six-, Eight-, and Ten-Carbon Alkyl Chains
• Activity Coefficients at Infinite Dilution for Organic Solutes Dissolved in Three 1-Alkyl-1-methylpyrrolidinium Bis(trifluoromethylsulfonyl)imide Ionic Liquids Bearing Short Linear Alkyl Side Chains of Three to Five Carbons
• Infinite Dilution Activity Coefficients of Solutes Dissolved in Two Trihexyl(tetradecyl)phosphonium Ionic Liquids
• Phase Equilibria of (1-Ethyl-3-methylimidazolium Ethylsulfate + Hydrocarbon, + Ketone, and + Ether) Binary Systems
• Volumetric and Transport Properties of Binary Liquid Mixtures of Aliphatic Ketones with Phenylacetonitrile at T = 308.15 K
• Activity Coefficients at Infinite Dilution of Organic Compounds in 1-Butyl-3-methylimidazolium Tetrafluoroborate Using Inverse Gas Chromatography
• Densities and Speeds of Sound for Binary Liquid Mixtures of Thiolane-l,l-dioxide with Butanone, Pentan-2-one, Pentan-3-one, and 4-Methyl-pentan-2-one at T = (303.15 or 308.15 or 313.15) K
• Partition Coefficients of Organic Compounds in New Imidazolium and Tetralkylammonium Based Ionic Liquids Using Inverse Gas Chromatography
• Henry s Law Constants of Organic Compounds in Water and n-Octane at T = 293.2 K
• Study of Ether-, Alcohol-, or Cyano-Functionalized Ionic Liquids Using Inverse Gas Chromatography
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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