Chemical Properties of Butanoic acid, methyl ester (CAS 623-42-7)

InChI

InChI=1S/C5H10O2/c1-3-4-5(6)7-2/h3-4H2,1-2H3

InChI Key

UUIQMZJEGPQKFD-UHFFFAOYSA-N

Formula

C5H10O2

SMILES

CCCC(=O)OC

Molecular Weight¹

102.13

CAS

623-42-7

Other Names

• Butyric acid, methyl ester
• Methyl butanoate
• Methyl butyrate
• Methyl ester of butanoic acid
• Methyl n-butanoate
• Methyl n-butyrate
• NSC 9380
• Propyl butyrate
• UN 1237
• n-Butyric acid methyl ester
• n-C3H7COOCH3

• 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_fusH° : Enthalpy of fusion at standard conditions (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).
• 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.
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• λ : Liquid thermal conductivity (W/m×K).
• T_fus : Normal melting (fusion) point (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	0.3800		KDB
PAff	836.40	kJ/mol	NIST
BasG	805.40	kJ/mol	NIST
ΔcH°liquid	-2900.00	kJ/mol	NIST
μ	1.70	debye	KDB
ΔfG°	-242.70	kJ/mol	Joback Calculated Property
ΔfH°gas	-452.65	kJ/mol	Relay (1.0) Calculated Property
ΔfusH°	11.36	kJ/mol	Phase equilibria and the thermodynamic properties of methyl and ethyl esters of carboxylic acids. 1. Methyl n-butanoate and ethyl propanoate
ΔvapH°	[39.00; 40.60]	kJ/mol
ΔvapH°	39.33	kJ/mol	NIST
ΔvapH°	40.30 ± 0.50	kJ/mol	NIST
ΔvapH°	40.60 ± 0.10	kJ/mol	NIST
ΔvapH°	40.60 ± 0.20	kJ/mol	NIST
ΔvapH°	39.30	kJ/mol	NIST
ΔvapH°	39.00 ± 0.40	kJ/mol	NIST
ΔvapH°	40.40	kJ/mol	NIST
ΔvapH°	40.10 ± 0.40	kJ/mol	NIST
ΔvapH°	39.80 ± 0.30	kJ/mol	NIST
ΔvapH°	39.28 ± 0.22	kJ/mol	NIST
ΔvapH°	39.30 ± 0.20	kJ/mol	NIST
IE	[10.07; 10.15]	eV
IE	10.07 ± 0.03	eV	NIST
IE	10.15	eV	NIST
log10WS	[-1.92; -0.82]
log10WS	-0.82		Aq. Solubility Prediction
log10WS	-1.92		Estimated Solubility
logPoct/wat	0.960		Crippen Calculated Property
McVol	88.750	ml/mol	McGowan Calculated Property
Pc	[3470.00; 3650.00]	kPa
Pc	3470.00	kPa	KDB
Pc	3473.00 ± 81.06	kPa	NIST
Pc	3470.40 ± 40.00	kPa	NIST
Pc	3650.00 ± 202.65	kPa	NIST
ρc	[291.08; 300.27]	kg/m3
ρc	300.17 ± 10.01	kg/m3	NIST
ρc	300.27 ± 4.09	kg/m3	NIST
ρc	291.08 ± 10.01	kg/m3	NIST
Inp	[676.00; 745.00]
Inp	705.60		NIST
Inp	719.90		NIST
Inp	719.10		NIST
Inp	718.90		NIST
Inp	697.00		NIST
Inp	723.00		NIST
Inp	706.00		NIST
Inp	710.00		NIST
Inp	710.00		NIST
Inp	709.00		NIST
Inp	717.00		NIST
Inp	706.00		NIST
Inp	711.00		NIST
Inp	702.00		NIST
Inp	715.00		NIST
Inp	714.00		NIST
Inp	704.00		NIST
Inp	714.00		NIST
Inp	705.00		NIST
Inp	708.00		NIST
Inp	705.00		NIST
Inp	708.00		NIST
Inp	705.00		NIST
Inp	710.00		NIST
Inp	702.00		NIST
Inp	710.00		NIST
Inp	710.00		NIST
Inp	717.00		NIST
Inp	727.00		NIST
Inp	724.00		NIST
Inp	724.00		NIST
Inp	723.00		NIST
Inp	Outlier 740.00		NIST
Inp	Outlier 690.00		NIST
Inp	723.00		NIST
Inp	730.00		NIST
Inp	696.00		NIST
Inp	724.00		NIST
Inp	707.00		NIST
Inp	696.00		NIST
Inp	696.00		NIST
Inp	719.00		NIST
Inp	720.00		NIST
Inp	719.00		NIST
Inp	720.00		NIST
Inp	709.50		NIST
Inp	707.20		NIST
Inp	708.00		NIST
Inp	720.00		NIST
Inp	720.60		NIST
Inp	728.00		NIST
Inp	735.00		NIST
Inp	731.00		NIST
Inp	717.00		NIST
Inp	Outlier 737.00		NIST
Inp	724.00		NIST
Inp	704.00		NIST
Inp	720.00		NIST
Inp	711.00		NIST
Inp	716.00		NIST
Inp	706.00		NIST
Inp	716.00		NIST
Inp	Outlier 676.00		NIST
Inp	721.00		NIST
Inp	728.00		NIST
Inp	723.00		NIST
Inp	705.00		NIST
Inp	698.00		NIST
Inp	724.00		NIST
Inp	723.00		NIST
Inp	710.00		NIST
Inp	710.00		NIST
Inp	710.00		NIST
Inp	714.00		NIST
Inp	722.00		NIST
Inp	724.00		NIST
Inp	706.00		NIST
Inp	722.00		NIST
Inp	712.00		NIST
Inp	705.00		NIST
Inp	705.00		NIST
Inp	703.00		NIST
Inp	706.00		NIST
Inp	705.00		NIST
Inp	705.00		NIST
Inp	709.00		NIST
Inp	710.00		NIST
Inp	706.00		NIST
Inp	Outlier 745.00		NIST
Inp	712.00		NIST
Inp	Outlier 745.00		NIST
Inp	729.00		NIST
Inp	722.00		NIST
Inp	725.00		NIST
Inp	724.00		NIST
Inp	702.00		NIST
Inp	723.00		NIST
Inp	702.00		NIST
Inp	717.00		NIST
Inp	705.00		NIST
Inp	725.00		NIST
Inp	715.00		NIST
Inp	723.00		NIST
Inp	723.00		NIST
Inp	726.00		NIST
Inp	723.00		NIST
Inp	720.00		NIST
Inp	705.00		NIST
Inp	706.00		NIST
Inp	704.00		NIST
Inp	706.00		NIST
Inp	706.00		NIST
Inp	723.00		NIST
Inp	702.00		NIST
Inp	704.00		NIST
Inp	705.00		NIST
Inp	723.00		NIST
Inp	705.60		NIST
Inp	723.00		NIST
Inp	717.00		NIST
Inp	714.00		NIST
Inp	705.00		NIST
Inp	710.00		NIST
Inp	720.60		NIST
Inp	Outlier 737.00		NIST
Inp	Outlier 745.00		NIST
Inp	725.00		NIST
Inp	706.00		NIST
Inp	702.00		NIST
Inp	721.00		NIST
Inp	724.00		NIST
Inp	712.00		NIST
Inp	716.00		NIST
Inp	730.00		NIST
Inp	696.00		NIST
Inp	709.50		NIST
I	[943.00; 1026.00]
I	982.00		NIST
I	997.00		NIST
I	1008.00		NIST
I	980.00		NIST
I	975.00		NIST
I	990.00		NIST
I	992.00		NIST
I	981.00		NIST
I	993.00		NIST
I	980.00		NIST
I	998.00		NIST
I	976.00		NIST
I	989.00		NIST
I	953.00		NIST
I	993.00		NIST
I	955.00		NIST
I	958.00		NIST
I	955.00		NIST
I	979.00		NIST
I	993.00		NIST
I	985.00		NIST
I	980.00		NIST
I	969.00		NIST
I	969.00		NIST
I	978.00		NIST
I	984.00		NIST
I	961.00		NIST
I	967.00		NIST
I	977.00		NIST
I	971.00		NIST
I	982.00		NIST
I	987.00		NIST
I	989.00		NIST
I	995.00		NIST
I	973.00		NIST
I	1001.00		NIST
I	965.00		NIST
I	971.00		NIST
I	1000.00		NIST
I	Outlier 1026.00		NIST
I	983.00		NIST
I	981.00		NIST
I	971.00		NIST
I	Outlier 943.00		NIST
I	986.00		NIST
I	982.00		NIST
I	981.00		NIST
I	992.00		NIST
I	992.00		NIST
I	989.00		NIST
I	1000.00		NIST
I	983.00		NIST
I	983.00		NIST
I	993.00		NIST
I	Outlier 945.00		NIST
I	985.00		NIST
I	975.00		NIST
I	982.00		NIST
I	984.00		NIST
I	1004.00		NIST
I	955.00		NIST
I	994.00		NIST
I	981.00		NIST
I	983.00		NIST
I	975.00		NIST
I	974.00		NIST
I	975.00		NIST
I	975.00		NIST
I	1000.00		NIST
I	985.00		NIST
I	980.00		NIST
I	1004.00		NIST
I	975.00		NIST
I	985.00		NIST
I	982.00		NIST
I	992.00		NIST
I	976.00		NIST
I	958.00		NIST
I	980.00		NIST
I	961.00		NIST
I	1001.00		NIST
Tboil	[369.05; 377.25]	K
Tboil	375.90	K	KDB
Tboil	375.53	K	Isobaric Vapor-Liquid Equilibria and Excess Properties for the Binary Systems of Methyl Esters + Heptane
Tboil	375.50	K	NIST
Tboil	374.00	K	NIST
Tboil	375.90	K	NIST
Tboil	375.15 ± 2.00	K	NIST
Tboil	373.65 ± 1.00	K	NIST
Tboil	377.25 ± 1.00	K	NIST
Tboil	375.65 ± 1.00	K	NIST
Tboil	375.00 ± 2.00	K	NIST
Tboil	375.80 ± 0.50	K	NIST
Tboil	375.80 ± 0.50	K	NIST
Tboil	375.80 ± 1.00	K	NIST
Tboil	374.75 ± 1.00	K	NIST
Tboil	375.90 ± 1.00	K	NIST
Tboil	375.95 ± 1.00	K	NIST
Tboil	375.00 ± 2.00	K	NIST
Tboil	375.65 ± 1.00	K	NIST
Tboil	375.90 ± 1.00	K	NIST
Tboil	375.50 ± 1.50	K	NIST
Tboil	375.65 ± 1.00	K	NIST
Tboil	376.65 ± 1.00	K	NIST
Tboil	Outlier 369.05 ± 1.00	K	NIST
Tboil	Outlier 369.05 ± 1.00	K	NIST
Tc	[544.70; 554.50]	K
Tc	554.40	K	KDB
Tc	554.50 ± 1.00	K	NIST
Tc	554.50 ± 1.00	K	NIST
Tc	551.20 ± 3.00	K	NIST
Tc	544.70 ± 8.00	K	NIST
Tfus	[184.55; 187.30]	K
Tfus	184.55	K	Aq. Solubility Prediction
Tfus	187.30	K	KDB
Vc	0.340	m3/kmol	KDB
Zc	0.2559460		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[163.46; 210.46]	J/mol×K	[390.09; 568.66]
Cp,gas	163.46	J/mol×K	390.09	Joback Calculated Property
Cp,gas	171.91	J/mol×K	419.85	Joback Calculated Property
Cp,gas	180.12	J/mol×K	449.61	Joback Calculated Property
Cp,gas	188.08	J/mol×K	479.38	Joback Calculated Property
Cp,gas	195.80	J/mol×K	509.14	Joback Calculated Property
Cp,gas	203.26	J/mol×K	538.90	Joback Calculated Property
Cp,gas	210.46	J/mol×K	568.66	Joback Calculated Property
Cp,liquid	[198.16; 200.80]	J/mol×K	[298.15; 298.15]
Cp,liquid	198.16	J/mol×K	298.15	NIST
Cp,liquid	200.80	J/mol×K	298.15	NIST
η	[0.0002744; 0.0027914]	Pa×s	[218.27; 390.09]
η	0.0027914	Pa×s	218.27	Joback Calculated Property
η	0.0015155	Pa×s	246.91	Joback Calculated Property
η	0.0009341	Pa×s	275.54	Joback Calculated Property
η	0.0006307	Pa×s	304.18	Joback Calculated Property
η	0.0004556	Pa×s	332.82	Joback Calculated Property
η	0.0003466	Pa×s	361.45	Joback Calculated Property
η	0.0002744	Pa×s	390.09	Joback Calculated Property
ΔvapH	[33.79; 42.80]	kJ/mol	[284.00; 460.00]
ΔvapH	41.10 ± 0.20	kJ/mol	284.00	NIST
ΔvapH	42.80	kJ/mol	310.50	NIST
ΔvapH	38.40	kJ/mol	338.50	NIST
ΔvapH	36.90	kJ/mol	350.00	NIST
ΔvapH	36.40	kJ/mol	366.50	NIST
ΔvapH	33.79	kJ/mol	375.90	NIST
ΔvapH	34.20	kJ/mol	460.00	NIST
Pvap	[1.06; 5.70]	kPa	[274.30; 303.20]
Pvap	1.06	kPa	274.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.29	kPa	276.40	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.40	kPa	278.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.49	kPa	279.40	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.63	kPa	281.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.71	kPa	281.60	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.85	kPa	283.40	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	1.96	kPa	283.70	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.10	kPa	285.50	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.24	kPa	285.80	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.54	kPa	288.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.52	kPa	288.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.47	kPa	288.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.93	kPa	290.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	3.09	kPa	291.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	2.94	kPa	291.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	3.21	kPa	292.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	3.38	kPa	293.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	3.72	kPa	294.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	4.07	kPa	295.30	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	4.48	kPa	298.10	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	5.22	kPa	300.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	5.30	kPa	301.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
Pvap	5.70	kPa	303.20	Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
n0	[1.37530; 1.38600]		[298.15; 318.15]
n0	1.38502		298.15	Excess molar volumes and excess molar enthalpies for binary mixtures of 1,2-dichloropropane with methyl ethanoate, methyl propanoate, and methyl butanoate at T = 298.15K
n0	1.38600		298.15	Thermodynamic study of (alkyl esters + alpha,omega-alkyl dihalides) IV: Hex and Vex for 25 binary mixtures {xC(u-1)H(2u-1)CO2CH3 + (1-x)alpha,omega-BrCH2(CH2)(v-2)CH2Br}, where u = 1 to 5, alpha = 1 and v = omega = 2 to 6
n0	1.38450		298.15	A Study on Alkane + Ester + Ester Systems. Physicochemical Behavior of Binaries and Ternaries of Octane or Iso-octane with Methyl Esters (Ethanoate, Butanoate, Pentanoate)
n0	1.38470		298.15	Vapor-Liquid Equilibrium Data for the Binary Methyl Esters (Butyrate, Pentanoate, and Hexanoate) (1) + Acetonitrile (2) Systems at 93.32 kPa
n0	1.38470		298.15	Vapor-Liquid Equilibrium Data for the Binary Methyl Esters (Butyrate, Pentanoate, and Hexanoate) (1) + Propanenitrile (2) Systems at 93.32 kPa
n0	1.38510		298.15	Measurements and Correlations of the Isobaric Vapor Liquid Equilibria of Binary Mixtures and Excess Properties for Mixtures Containing an Alkyl (Methyl, Ethyl) Butanoate with an Alkane (Heptane, Nonane) at 101.3 kPa
n0	1.37530		318.15	Excess Properties and Isobaric Vapor-Liquid Equilibria for Binary Mixtures of Methyl Esters + tert-Butanol
ρl	[741.06; 903.34]	kg/m3	[288.15; 423.15]
ρl	903.34	kg/m3	288.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	898.00	kg/m3	293.00	KDB
ρl	898.05	kg/m3	293.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	897.88	kg/m3	293.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	892.62	kg/m3	298.15	Densities and interfacial tensions for fatty acid methyl esters (from methyl formate to methyl heptanoate) + water demixed mixtures at atmospheric pressure conditions
ρl	892.38	kg/m3	298.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	886.90	kg/m3	303.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	886.86	kg/m3	303.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	881.30	kg/m3	308.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	875.74	kg/m3	313.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	875.70	kg/m3	313.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	870.14	kg/m3	318.15	Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
ρl	863.41	kg/m3	323.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	853.04	kg/m3	333.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	841.50	kg/m3	343.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	829.80	kg/m3	353.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	817.71	kg/m3	363.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	806.03	kg/m3	373.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	793.68	kg/m3	383.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	780.99	kg/m3	393.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	767.63	kg/m3	403.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	754.74	kg/m3	413.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
ρl	741.06	kg/m3	423.15	Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
λ	[0.12; 0.15]	W/m×K	[283.34; 358.18]
λ	0.15	W/m×K	283.34	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	288.30	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	293.39	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	297.41	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	298.44	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	301.30	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	305.42	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	309.31	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.14	W/m×K	313.29	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.13	W/m×K	318.38	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.13	W/m×K	323.35	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.13	W/m×K	328.55	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.13	W/m×K	333.25	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.13	W/m×K	338.40	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.12	W/m×K	343.25	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.12	W/m×K	348.24	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.12	W/m×K	353.35	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
λ	0.12	W/m×K	358.18	Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel

Datasets

Mass density, kg/m3

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Mass density, kg/m3 - Liquid
293.15	100.00	898.42
293.15	1000.00	898.68
293.15	3000.00	900.65
293.15	5000.00	902.15
293.15	10000.00	906.55
293.15	15000.00	910.63
293.15	20000.00	914.51
293.15	25000.00	918.33
293.15	30000.00	921.95
293.15	35000.00	925.38
293.15	40000.00	928.67
293.15	50000.00	935.38
293.15	60000.00	941.12
303.15	100.00	886.68
303.15	1000.00	887.75
303.15	3000.00	889.67
303.15	5000.00	891.54
303.15	10000.00	895.99
303.15	15000.00	900.35
303.15	20000.00	904.45
303.15	25000.00	908.4
303.15	30000.00	912.18
303.15	35000.00	915.86
303.15	40000.00	919.34
303.15	50000.00	926.18
303.15	60000.00	932.54
313.15	100.00	875.83
313.15	1000.00	876.3
313.15	3000.00	878.42
313.15	5000.00	880.45
313.15	10000.00	885.34
313.15	15000.00	889.92
313.15	20000.00	894.25
313.15	25000.00	898.53
313.15	30000.00	902.47
313.15	35000.00	906.46
313.15	40000.00	910.02
313.15	50000.00	917.24
313.15	60000.00	923.73
323.15	100.00	864.35
323.15	1000.00	865.42
323.15	3000.00	867.62
323.15	5000.00	869.76
323.15	10000.00	875.02
323.15	15000.00	879.93
323.15	20000.00	884.63
323.15	25000.00	888.92
323.15	30000.00	893.19
323.15	35000.00	897.21
323.15	40000.00	901.15
323.15	50000.00	908.62
323.15	60000.00	915.65
333.15	100.00	853.11
333.15	1000.00	854.08
333.15	3000.00	856.55
333.15	5000.00	858.82
333.15	10000.00	864.28
333.15	15000.00	869.44
333.15	20000.00	874.46
333.15	25000.00	879.2
333.15	30000.00	883.56
333.15	35000.00	887.79
333.15	40000.00	892.1
333.15	50000.00	899.8
333.15	60000.00	906.96
343.15	100.00	841.05
343.15	1000.00	842.4
343.15	3000.00	844.95
343.15	5000.00	847.57
343.15	10000.00	853.35
343.15	15000.00	858.9
343.15	20000.00	864.31
343.15	25000.00	869.1
343.15	30000.00	873.89
343.15	35000.00	878.44
343.15	40000.00	882.65
343.15	50000.00	890.89
343.15	60000.00	898.16
353.15	100.00	829.58
353.15	1000.00	830.8
353.15	3000.00	833.71
353.15	5000.00	836.31
353.15	10000.00	842.65
353.15	15000.00	848.71
353.15	20000.00	854.19
353.15	25000.00	859.51
353.15	30000.00	864.51
353.15	35000.00	869.35
353.15	40000.00	873.76
353.15	50000.00	882.24
353.15	60000.00	890.18
363.15	100.00	817.31
363.15	1000.00	818.87
363.15	3000.00	821.94
363.15	5000.00	824.91
363.15	10000.00	831.48
363.15	15000.00	838.19
363.15	20000.00	843.84
363.15	25000.00	849.26
363.15	30000.00	854.68
363.15	35000.00	859.76
363.15	40000.00	864.61
363.15	50000.00	873.56
363.15	60000.00	881.85
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.63]	kPa	[277.56; 398.97]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.46637e+01
Coefficient B			-3.24931e+03
Coefficient C			-5.15380e+01
Temperature range, min.			277.56
Temperature range, max.			398.97
Pvap	1.33	kPa	277.56	Calculated Property
Pvap	3.00	kPa	291.05	Calculated Property
Pvap	6.18	kPa	304.54	Calculated Property
Pvap	11.83	kPa	318.03	Calculated Property
Pvap	21.29	kPa	331.52	Calculated Property
Pvap	36.30	kPa	345.01	Calculated Property
Pvap	59.05	kPa	358.50	Calculated Property
Pvap	92.20	kPa	371.99	Calculated Property
Pvap	138.87	kPa	385.48	Calculated Property
Pvap	202.63	kPa	398.97	Calculated Property
Pvap	[1.01e-04; 3451.09]	kPa	[187.35; 554.50]	KDB Vapor Pressure Data
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			9.73784e+01
Coefficient B			-8.00472e+03
Coefficient C			-1.22593e+01
Coefficient D			8.64840e-06
Temperature range, min.			187.35
Temperature range, max.			554.50
Pvap	1.01e-04	kPa	187.35	Calculated Property
Pvap	0.02	kPa	228.14	Calculated Property
Pvap	0.71	kPa	268.94	Calculated Property
Pvap	7.75	kPa	309.73	Calculated Property
Pvap	43.47	kPa	350.53	Calculated Property
Pvap	158.35	kPa	391.32	Calculated Property
Pvap	433.02	kPa	432.12	Calculated Property
Pvap	974.69	kPa	472.91	Calculated Property
Pvap	1919.85	kPa	513.71	Calculated Property
Pvap	3451.09	kPa	554.50	Calculated Property

Similar Compounds

Find more compounds similar to Butanoic acid, methyl ester.

Mixtures

• Butanoic acid, methyl ester + Propane, 1,2-dichloro-
• Butanoic acid, methyl ester + Ethane, 1,2-dibromo-
• Butanoic acid, methyl ester + Propane, 1,3-dibromo-
• Butanoic acid, methyl ester + Butane, 1,4-dibromo-
• Butanoic acid, methyl ester + Pentane, 1,5-dibromo-
• Butanoic acid, methyl ester + Hexane, 1,6-dibromo-
• Butanoic acid, methyl ester + Water
• Butanoic acid, methyl ester + Octane
• Butanoic acid, methyl ester + Pentane, 2,2,4-trimethyl-
• Butanoic acid, methyl ester + Acetic acid, methyl ester
• Butanoic acid, methyl ester + Octane + Acetic acid, methyl ester
• Butanoic acid, methyl ester + Pentane, 2,2,4-trimethyl- + Acetic acid, methyl ester
• Butanoic acid, methyl ester + Dodecane
• Butanoic acid, methyl ester + Dodecane + Decanoic acid, methyl ester
• Butanoic acid, methyl ester + Heptane
• 2-Propanol, 2-methyl- + Butanoic acid, methyl ester
• Butanoic acid, methyl ester + Acetonitrile
• Butanoic acid, methyl ester + Propanenitrile
• Butanoic acid, methyl ester + Nonane

Sources

• KDB Vapor Pressure Data
• Cheméo Relay (1.0)
• Crippen Method
• Transpiration method: Vapor pressures and enthalpies of vaporization of some low-boiling esters
• Excess molar volumes and excess molar enthalpies for binary mixtures of 1,2-dichloropropane with methyl ethanoate, methyl propanoate, and methyl butanoate at T = 298.15K
• 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
• High-pressure liquid densities of fatty acid methyl esters: Measurement and prediction with the PC-SAFT equation of state
• 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
• Thermodynamic study of (alkyl esters + alpha,omega-alkyl dihalides) IV: Hex and Vex for 25 binary mixtures {xC(u-1)H(2u-1)CO2CH3 + (1-x)alpha,omega-BrCH2(CH2)(v-2)CH2Br}, where u = 1 to 5, alpha = 1 and v = omega = 2 to 6
• Phase equilibria and the thermodynamic properties of methyl and ethyl esters of carboxylic acids. 1. Methyl n-butanoate and ethyl propanoate
• 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
• 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
• 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
• 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
• Thermodynamics and activity coefficients at infinite dilution for organic solutes, water and diols in the ionic liquid choline bis(trifluoromethylsulfonyl)imide
• 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
• Thermodynamics and limiting activity coefficients measurements for organic solutes and water in the ionic liquid 1-dodecyl-3-methylimidzolium bis(trifluoromethylsulfonyl) imide
• 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
• Densities and interfacial tensions for fatty acid methyl esters (from methyl formate to methyl heptanoate) + water demixed mixtures at atmospheric pressure conditions
• Thermodynamic study of molecular interaction-selectivity in separation processes based on limiting activity coefficients
• Experimental investigations on the liquid thermal conductivity of five saturated fatty acid methyl esters components of biodiesel
• The use of ionic liquids for separation of binary hydrocarbons mixtures based on gamma infinity data measurements
• A Study on Alkane + Ester + Ester Systems. Physicochemical Behavior of Binaries and Ternaries of Octane or Iso-octane with Methyl Esters (Ethanoate, Butanoate, Pentanoate)
• Experimental Investigation of the Thermophysical Properties of the Bio-Aviation Fuel Surrogates: Binary and Ternary Mixtures of n-Dodecane, Methyl Butyrate, and Methyl Decanoate
• Isobaric Vapor-Liquid Equilibria and Excess Properties for the Binary Systems of Methyl Esters + Heptane
• Excess Properties and Isobaric Vapor-Liquid Equilibria for Binary Mixtures of Methyl Esters + tert-Butanol
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 8. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in 1-Hexyl-3-methylimidazolium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography
• Thermodynamic Properties of Mixtures Containing Ionic Liquids. 9. Activity Coefficients at Infinite Dilution of Hydrocarbons, Alcohols, Esters, and Aldehydes in Trimethyl-butylammonium Bis(trifluoromethylsulfonyl) Imide Using Gas-Liquid Chromatography and Static Method
• Vapor-Liquid Equilibrium Data for the Binary Methyl Esters (Butyrate, Pentanoate, and Hexanoate) (1) + Acetonitrile (2) Systems at 93.32 kPa
• Experimental Study of Thermodynamic Properties of Mixtures Containing Ionic Liquid 1-Ethyl-3-methylimidazolium Ethyl Sulfate Using Gas-Liquid Chromatography and Transpiration Method
• Vapor-Liquid Equilibrium Data for the Binary Methyl Esters (Butyrate, Pentanoate, and Hexanoate) (1) + Propanenitrile (2) Systems at 93.32 kPa
• Thermal and Volumetric Properties of Four Aqueous Aroma Compounds at Infinite Dilution
• Measurements and Correlations of the Isobaric Vapor Liquid Equilibria of Binary Mixtures and Excess Properties for Mixtures Containing an Alkyl (Methyl, Ethyl) Butanoate with an Alkane (Heptane, Nonane) at 101.3 kPa
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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