Chemical Properties of Phenol, 3-methyl- (CAS 108-39-4)

InChI

InChI=1S/C7H8O/c1-6-3-2-4-7(8)5-6/h2-5,8H,1H3

InChI Key

RLSSMJSEOOYNOY-UHFFFAOYSA-N

Formula

C7H8O

SMILES

Cc1cccc(O)c1

Molecular Weight¹

108.14

CAS

108-39-4

Other Names

• 1-hydroxy-3-methylbenzene
• 3-Cresol
• 3-Hydroxytoluene
• 3-methylphenol
• Cresol, meta
• Cresol,m-
• NSC 8768
• Rcra waste number U052
• m-Cresole
• m-Cresylic acid
• m-Kresol
• m-Oxytoluene
• m-Toluol
• m-cresol
• m-hydroxytoluene
• m-methylphenol
• meta-cresol
• meta-hydroxytoluene

• 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_subH : Enthalpy of sublimation 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_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).
• γ : Surface Tension (N/m).
• T_boil : Normal Boiling Point Temperature (K).
• T_boil : Boiling point at given pressure (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	0.4540		KDB
PAff	841.00 ± 8.00	kJ/mol	NIST
BasG	809.00 ± 8.00	kJ/mol	NIST
ΔcH°liquid	[-3721.00; -3694.00]	kJ/mol
ΔcH°liquid	-3704.70 ± 0.30	kJ/mol	NIST
ΔcH°liquid	-3703.90 ± 0.59	kJ/mol	NIST
ΔcH°liquid	-3721.00	kJ/mol	NIST
ΔcH°liquid	-3704.40	kJ/mol	NIST
ΔcH°liquid	-3694.00	kJ/mol	NIST
μ	1.80	debye	KDB
ΔfG°	-40.57	kJ/mol	KDB
ΔfH°gas	[-133.80; -117.30]	kJ/mol
ΔfH°gas	-132.40	kJ/mol	KDB
ΔfH°gas	-133.60 ± 1.10	kJ/mol	NIST
ΔfH°gas	-132.30 ± 1.10	kJ/mol	NIST
ΔfH°gas	-117.30	kJ/mol	NIST
ΔfH°gas	-133.80	kJ/mol	NIST
ΔfH°liquid	[-194.10; -177.00]	kJ/mol
ΔfH°liquid	-193.30	kJ/mol	NIST
ΔfH°liquid	-194.10 ± 1.10	kJ/mol	NIST
ΔfH°liquid	-177.00	kJ/mol	NIST
ΔfH°liquid	-193.50	kJ/mol	NIST
ΔfusH°	13.71	kJ/mol	Joback Calculated Property
ΔvapH°	[46.28; 65.00]	kJ/mol
ΔvapH°	65.00 ± 0.70	kJ/mol	NIST
ΔvapH°	62.50	kJ/mol	NIST
ΔvapH°	61.70	kJ/mol	NIST
ΔvapH°	59.70	kJ/mol	NIST
ΔvapH°	61.70 ± 1.00	kJ/mol	NIST
ΔvapH°	61.80	kJ/mol	NIST
ΔvapH°	61.70	kJ/mol	NIST
ΔvapH°	Outlier 46.28	kJ/mol	NIST
IE	[8.23; 8.98]	eV
IE	8.29 ± 0.02	eV	NIST
IE	8.36 ± 0.11	eV	NIST
IE	8.29 ± 0.02	eV	NIST
IE	8.23	eV	NIST
IE	8.52 ± 0.05	eV	NIST
IE	Outlier 8.98	eV	NIST
IE	8.41	eV	NIST
IE	8.52	eV	NIST
log10WS	[-0.68; -0.68]
log10WS	-0.68		Aq. Solubility Prediction
log10WS	-0.68		Estimated Solubility
logPoct/wat	1.701		Crippen Calculated Property
McVol	91.600	ml/mol	McGowan Calculated Property
NFPA Fire	1		KDB
NFPA Health	2		KDB
Pc	[4360.00; 4564.69]	kPa
Pc	4560.00	kPa	KDB
Pc	Outlier 4360.00 ± 588.40	kPa	NIST
Pc	4559.63 ± 303.98	kPa	NIST
Pc	4560.00 ± 91.19	kPa	NIST
Pc	4554.56 ± 151.99	kPa	NIST
Pc	4564.69 ± 151.99	kPa	NIST
Inp	[171.00; 1105.00]
Inp	1045.00		NIST
Inp	1059.00		NIST
Inp	1052.00		NIST
Inp	1059.00		NIST
Inp	1036.00		NIST
Inp	1028.90		NIST
Inp	1034.50		NIST
Inp	1037.00		NIST
Inp	1037.00		NIST
Inp	1050.00		NIST
Inp	1050.00		NIST
Inp	1050.00		NIST
Inp	1065.00		NIST
Inp	1075.00		NIST
Inp	1105.00		NIST
Inp	1063.00		NIST
Inp	1065.00		NIST
Inp	1077.00		NIST
Inp	1084.00		NIST
Inp	1053.10		NIST
Inp	1051.70		NIST
Inp	1056.00		NIST
Inp	1054.00		NIST
Inp	1065.00		NIST
Inp	1068.00		NIST
Inp	1051.00		NIST
Inp	1064.00		NIST
Inp	1077.00		NIST
Inp	1070.00		NIST
Inp	1073.90		NIST
Inp	1075.00		NIST
Inp	1064.00		NIST
Inp	1062.00		NIST
Inp	1057.00		NIST
Inp	1057.00		NIST
Inp	1083.00		NIST
Inp	1074.00		NIST
Inp	1100.00		NIST
Inp	1093.00		NIST
Inp	1081.00		NIST
Inp	1075.00		NIST
Inp	1051.00		NIST
Inp	1055.00		NIST
Inp	1055.00		NIST
Inp	1075.00		NIST
Inp	1055.00		NIST
Inp	1075.00		NIST
Inp	1048.00		NIST
Inp	1090.00		NIST
Inp	1071.00		NIST
Inp	1047.00		NIST
Inp	1048.00		NIST
Inp	1091.00		NIST
Inp	1044.00		NIST
Inp	1075.00		NIST
Inp	1073.00		NIST
Inp	1066.00		NIST
Inp	1066.00		NIST
Inp	1070.00		NIST
Inp	1048.00		NIST
Inp	1086.00		NIST
Inp	1068.00		NIST
Inp	1068.00		NIST
Inp	1075.00		NIST
Inp	1067.00		NIST
Inp	1065.00		NIST
Inp	1079.00		NIST
Inp	1052.00		NIST
Inp	1057.00		NIST
Inp	1065.00		NIST
Inp	1073.00		NIST
Inp	1077.00		NIST
Inp	1065.00		NIST
Inp	Outlier 175.80		NIST
Inp	Outlier 176.00		NIST
Inp	Outlier 175.79		NIST
Inp	Outlier 178.68		NIST
Inp	Outlier 175.40		NIST
Inp	Outlier 177.63		NIST
Inp	Outlier 171.00		NIST
Inp	Outlier 175.80		NIST
Inp	Outlier 177.63		NIST
Inp	Outlier 177.95		NIST
Inp	Outlier 171.00		NIST
Inp	1062.00		NIST
Inp	1077.00		NIST
Inp	1054.00		NIST
Inp	1057.00		NIST
Inp	1093.00		NIST
Inp	1055.00		NIST
Inp	1090.00		NIST
Inp	1044.00		NIST
Inp	Outlier 175.80		NIST
Inp	Outlier 177.63		NIST
Inp	1065.00		NIST
I	[2059.00; 2140.00]
I	2129.00		NIST
I	2067.00		NIST
I	2109.90		NIST
I	2093.00		NIST
I	2085.00		NIST
I	2100.00		NIST
I	2129.00		NIST
I	2091.00		NIST
I	2097.00		NIST
I	2109.00		NIST
I	2097.00		NIST
I	2067.00		NIST
I	2081.00		NIST
I	2083.00		NIST
I	2109.09		NIST
I	2102.63		NIST
I	2109.90		NIST
I	2100.00		NIST
I	2099.00		NIST
I	2081.00		NIST
I	2129.00		NIST
I	Outlier 2140.00		NIST
I	2068.00		NIST
I	Outlier 2135.00		NIST
I	2077.00		NIST
I	2103.00		NIST
I	2071.00		NIST
I	2111.00		NIST
I	2080.00		NIST
I	2107.00		NIST
I	2115.00		NIST
I	2112.00		NIST
I	2090.00		NIST
I	2114.00		NIST
I	2116.00		NIST
I	2065.00		NIST
I	2088.00		NIST
I	2060.00		NIST
I	2069.00		NIST
I	2106.00		NIST
I	2068.00		NIST
I	2090.00		NIST
I	2091.00		NIST
I	2064.00		NIST
I	2080.00		NIST
I	2085.00		NIST
I	2083.00		NIST
I	2108.00		NIST
I	2059.00		NIST
I	2059.00		NIST
I	2100.00		NIST
I	2091.00		NIST
I	2108.00		NIST
S°liquid	212.59	J/mol×K	NIST
Tboil	[474.15; 475.95]	K
Tboil	475.35	K	Experimental and Predicted Vapor-Liquid Equilibrium for Diisopropanolamine with m-Cresol and 2,6-Dimethylphenol at 20.0 kPa
Tboil	475.42	K	KDB
Tboil	475.50 ± 0.50	K	NIST
Tboil	475.50 ± 0.30	K	NIST
Tboil	475.40	K	NIST
Tboil	475.25 ± 1.00	K	NIST
Tboil	474.95 ± 1.00	K	NIST
Tboil	475.35 ± 1.00	K	NIST
Tboil	475.35 ± 1.00	K	NIST
Tboil	475.35 ± 0.40	K	NIST
Tboil	475.85 ± 0.30	K	NIST
Tboil	474.65 ± 1.00	K	NIST
Tboil	475.15 ± 2.00	K	NIST
Tboil	Outlier 474.15 ± 2.00	K	NIST
Tboil	475.28 ± 0.50	K	NIST
Tboil	475.25 ± 1.00	K	NIST
Tboil	474.95 ± 1.00	K	NIST
Tboil	Outlier 474.20 ± 1.00	K	NIST
Tboil	475.15 ± 1.00	K	NIST
Tboil	475.95 ± 2.00	K	NIST
Tc	[705.00; 705.80]	K
Tc	705.80	K	KDB
Tc	705.80 ± 0.40	K	NIST
Tc	705.75 ± 0.45	K	NIST
Tc	705.15 ± 2.00	K	NIST
Tc	705.00 ± 2.50	K	NIST
Tc	705.15 ± 2.00	K	NIST
Tfus	[277.65; 285.37]	K
Tfus	284.90	K	KDB
Tfus	284.67	K	Aq. Solubility Prediction
Tfus	281.00 ± 0.20	K	NIST
Tfus	285.37 ± 0.05	K	NIST
Tfus	284.15 ± 0.60	K	NIST
Tfus	285.35 ± 0.10	K	NIST
Tfus	283.35 ± 0.50	K	NIST
Tfus	284.65 ± 0.50	K	NIST
Tfus	285.05 ± 0.20	K	NIST
Tfus	285.05 ± 0.30	K	NIST
Tfus	285.10 ± 0.20	K	NIST
Tfus	284.40 ± 0.40	K	NIST
Tfus	281.15 ± 2.00	K	NIST
Tfus	282.55 ± 0.50	K	NIST
Tfus	284.25 ± 0.20	K	NIST
Tfus	283.15 ± 0.70	K	NIST
Tfus	Outlier 277.65 ± 0.20	K	NIST
Tfus	284.05 ± 1.00	K	NIST
Ttriple	[285.40; 285.40]	K
Ttriple	285.40 ± 0.02	K	NIST
Ttriple	285.40 ± 0.02	K	NIST
Vc	0.309	m3/kmol	KDB
Zc	0.2401070		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[184.27; 237.56]	J/mol×K	[466.86; 696.68]
Cp,gas	184.27	J/mol×K	466.86	Joback Calculated Property
Cp,gas	195.06	J/mol×K	505.16	Joback Calculated Property
Cp,gas	204.98	J/mol×K	543.47	Joback Calculated Property
Cp,gas	214.11	J/mol×K	581.77	Joback Calculated Property
Cp,gas	222.53	J/mol×K	620.08	Joback Calculated Property
Cp,gas	230.32	J/mol×K	658.38	Joback Calculated Property
Cp,gas	237.56	J/mol×K	696.68	Joback Calculated Property
Cp,liquid	[216.70; 224.93]	J/mol×K	[93.00; 298.15]
Cp,liquid	220.90	J/mol×K	93.00	NIST
Cp,liquid	216.70	J/mol×K	283.00	NIST
Cp,liquid	218.80	J/mol×K	298.00	NIST
Cp,liquid	224.93	J/mol×K	298.15	NIST
η	[0.0017590; 0.0077010]	Pa×s	[308.15; 353.15]
η	0.0077010	Pa×s	308.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0061200	Pa×s	313.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0050220	Pa×s	318.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0041580	Pa×s	323.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0035180	Pa×s	328.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0029800	Pa×s	333.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0022310	Pa×s	343.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
η	0.0017590	Pa×s	353.15	Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
ΔfusH	[8.90; 10.71]	kJ/mol	[280.75; 285.40]
ΔfusH	9.10	kJ/mol	280.75	NIST
ΔfusH	9.10	kJ/mol	280.80	NIST
ΔfusH	8.90	kJ/mol	282.30	NIST
ΔfusH	9.41	kJ/mol	285.00	NIST
ΔfusH	10.67	kJ/mol	285.30	NIST
ΔfusH	10.71	kJ/mol	285.40	NIST
ΔfusH	10.71	kJ/mol	285.40	NIST
ΔfusH	10.71	kJ/mol	285.40	NIST
ΔfusH	10.71	kJ/mol	285.40	NIST
ΔsubH	[56.10; 61.70]	kJ/mol	[279.00; 298.50]
ΔsubH	56.10	kJ/mol	279.00	NIST
ΔsubH	61.70 ± 1.00	kJ/mol	298.50	NIST
ΔsubH	61.70 ± 1.00	kJ/mol	298.50	NIST
ΔvapH	[43.80; 63.10]	kJ/mol	[350.50; 578.00]
ΔvapH	63.10	kJ/mol	350.50	NIST
ΔvapH	60.60	kJ/mol	408.50	NIST
ΔvapH	58.80	kJ/mol	416.00	NIST
ΔvapH	55.00	kJ/mol	428.00	NIST
ΔvapH	55.00	kJ/mol	428.00	NIST
ΔvapH	52.70	kJ/mol	443.50	NIST
ΔvapH	50.70	kJ/mol	448.00	NIST
ΔvapH	47.41	kJ/mol	475.40	KDB
ΔvapH	47.60	kJ/mol	501.00	NIST
ΔvapH	43.80	kJ/mol	578.00	NIST
Pvap	20.00	kPa	422.25	Experimental and predicted vapor-liquid equilibrium for binary systems with diethanolamine, m-cresol and p-cresol at 20.0 kPa
n0	[1.53200; 1.54140]		[293.15; 308.15]
n0	1.54140		293.15	Excess Gibbs' energies of the binary mixtures formed by N,N-dimethylformamide with xylenes and cresols at 95.1 kPa
n0	1.54010		293.15	Activity Coefficients at Infinite Dilution and Excess Molar Volumes in Binary Mixtures Containing Normal Alkanes (Nonane, Decane, Undecane, or Dodecane) and Cresols (2-Methylphenol or 3-Methylphenol)
n0	1.53950		298.15	Excess Gibbs energies of binary mixtures formed by nitrobenzene with selected compounds at 94.95 kPa
n0	1.53950		298.15	(Vapor + liquid) equilibria of the binary mixtures of m-cresol with C1 C4 aliphatic alcohols at 95.5 kPa
n0	1.53800		298.15	Densities, Speeds of Sound, and Refractive Indices of Binary Mixtures of Decan-1-ol with Anisole, o-Cresol, m-Cresol, and p-Cresol at T = (298.15, 303.15, and 308.15) K
n0	1.53500		303.15	Densities, Speeds of Sound, and Refractive Indices of Binary Mixtures of Decan-1-ol with Anisole, o-Cresol, m-Cresol, and p-Cresol at T = (298.15, 303.15, and 308.15) K
n0	1.53200		308.15	Densities, Speeds of Sound, and Refractive Indices of Binary Mixtures of Decan-1-ol with Anisole, o-Cresol, m-Cresol, and p-Cresol at T = (298.15, 303.15, and 308.15) K
ρl	[993.63; 1034.50]	kg/m3	[293.00; 343.15]
ρl	1034.00	kg/m3	293.00	KDB
ρl	1033.85	kg/m3	293.15	Liquid-Liquid Equilibria in Ternary Systems of Aromatic Hydrocarbons (Toluene or Ethylbenzene) + Phenols + Water
ρl	1033.84	kg/m3	293.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1033.85	kg/m3	293.15	Liquid-Liquid(-Liquid) Equilibria in Ternary Systems of Aliphatic Hydrocarbons (Heptane or Octane) + Phenols + Water
ρl	1029.91	kg/m3	298.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1034.50	kg/m3	298.20	Phase Equilibrium Measurement and Thermodynamic Modeling of the 4-Methylpentan-2-one/3-Methylphenol, and 4-Methylphenol/Water Ternary Systems at 298.2, 313.2, and 323.2 K and 0.1 MPa
ρl	1025.96	kg/m3	303.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1025.71	kg/m3	303.15	Thermodynamic and spectroscopic study of molecular interactions between ethanol and isomeric cresols
ρl	1025.95	kg/m3	303.15	Vapor-Liquid Equilibria in Ternary Systems of Toluene or Octane + Phenols + Water
ρl	1021.99	kg/m3	308.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1021.70	kg/m3	308.15	Thermodynamic and spectroscopic study of molecular interactions between ethanol and isomeric cresols
ρl	1017.69	kg/m3	313.15	Thermodynamic and spectroscopic study of molecular interactions between ethanol and isomeric cresols
ρl	1018.00	kg/m3	313.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1013.99	kg/m3	318.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1013.65	kg/m3	318.15	Thermodynamic and spectroscopic study of molecular interactions between ethanol and isomeric cresols
ρl	1009.97	kg/m3	323.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1009.20	kg/m3	323.20	Liquid-liquid equilibrium for methyl butyl ketone + o-, m-, p-cresol + water ternary systems and COSMO-SAC predictions
ρl	1005.91	kg/m3	328.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	1001.84	kg/m3	333.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	997.74	kg/m3	338.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ρl	993.63	kg/m3	343.15	Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
ΔfusS	[27.53; 33.03]	J/mol×K	[280.75; 285.40]
ΔfusS	32.00	J/mol×K	280.75	NIST
ΔfusS	33.03	J/mol×K	285.00	NIST
ΔfusS	27.53	J/mol×K	285.40	NIST
ΔfusS	27.53	J/mol×K	285.40	NIST
γ	0.04	N/m	298.20	KDB

Pressure Dependent Properties

Property	Value	Unit	Pressure (kPa)	Source
Tboil	[402.24; 428.56]	K	[9.29; 25.13]
Tboil	402.24	K	9.29	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	408.55	K	11.93	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	413.39	K	14.57	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	417.47	K	16.68	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	420.54	K	18.79	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	422.16	K	20.00	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	423.55	K	20.91	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	426.04	K	23.02	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
Tboil	428.56	K	25.13	Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa

Datasets

Mass density, kg/m3

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Mass density, kg/m3 - Liquid
313.22	1001.00	1019.1
313.22	2012.00	1019.8
313.22	3024.00	1020.3
313.22	4007.00	1020.9
313.22	4992.00	1021.4
313.22	6027.00	1022.0
313.22	7013.00	1022.6
313.22	8000.00	1023.1
313.22	9008.00	1023.7
313.22	10014.00	1024.3
313.22	11015.00	1024.8
313.22	12040.00	1025.4
313.22	13022.00	1026.0
313.22	14023.00	1026.4
313.22	15002.00	1026.9
313.22	16009.00	1027.5
313.22	17020.00	1028.0
313.22	18021.00	1028.5
313.22	19016.00	1029.0
313.22	20026.00	1029.6
313.22	21024.00	1030.1
313.22	22026.00	1030.7
313.22	23030.00	1031.1
313.22	24017.00	1031.6
313.22	25019.00	1032.2
322.90	1014.00	1011.2
322.90	2041.00	1011.8
322.90	3002.00	1012.4
322.90	4014.00	1013.0
322.90	5012.00	1013.6
322.90	6022.00	1014.2
322.90	7020.00	1014.7
322.90	8018.00	1015.3
322.90	9020.00	1015.9
322.90	10005.00	1016.4
322.90	11018.00	1017.0
322.90	12019.00	1017.6
322.90	13017.00	1018.2
322.90	14010.00	1018.7
322.90	15022.00	1019.3
322.90	16000.00	1019.8
322.90	17011.00	1020.4
322.90	18018.00	1020.9
322.90	19018.00	1021.4
322.90	20009.00	1022.0
322.90	21019.00	1022.6
322.90	22019.00	1023.1
322.90	23006.00	1023.6
322.90	24012.00	1024.1
322.90	25019.00	1024.7
332.61	1018.00	1003.3
332.61	2014.00	1004.0
332.61	3003.00	1004.5
332.61	4030.00	1005.2
332.61	5000.00	1005.8
332.61	6022.00	1006.4
332.61	7020.00	1006.9
332.61	8020.00	1007.5
332.61	9003.00	1008.1
332.61	10014.00	1008.7
332.61	11012.00	1009.3
332.61	12000.00	1009.9
332.61	13000.00	1010.4
332.61	14028.00	1011.0
332.61	15028.00	1011.6
332.61	16023.00	1012.2
332.61	17000.00	1012.7
332.61	18008.00	1013.3
332.61	19000.00	1013.9
332.61	20001.00	1014.4
332.61	21013.00	1014.9
332.61	22010.00	1015.5
332.61	23007.00	1016.0
332.61	24000.00	1016.6
332.61	25008.00	1017.1
342.27	2018.00	995.8
342.27	2999.00	996.4
342.27	3998.00	997.0
342.27	4976.00	997.6
342.27	5984.00	998.3
342.27	7059.00	998.9
342.27	8070.00	999.7
342.27	8967.00	1000.2
342.27	9994.00	1000.8
342.27	10921.00	1001.4
342.27	11964.00	1002.1
342.27	12971.00	1002.6
342.27	13954.00	1003.2
342.27	14960.00	1004.0
342.27	15941.00	1004.3
342.27	16963.00	1005.1
342.27	17992.00	1005.8
342.27	18963.00	1006.2
342.27	19996.00	1006.7
342.27	21003.00	1007.5
342.27	21974.00	1008.0
342.27	22968.00	1008.7
342.27	24051.00	1009.2
342.27	24971.00	1009.7
352.06	1951.00	988.5
352.06	2979.00	989.1
352.06	4034.00	989.8
352.06	4966.00	990.3
352.06	5929.00	990.9
352.06	7014.00	991.6
352.06	8011.00	992.2
352.06	8921.00	992.8
352.06	9982.00	993.4
352.06	10938.00	994.0
352.06	11975.00	994.6
352.06	12999.00	995.3
352.06	13907.00	995.8
352.06	14981.00	996.5
352.06	15966.00	997.1
352.06	16996.00	997.7
352.06	17984.00	998.3
352.06	18991.00	998.9
352.06	20005.00	999.5
352.06	21038.00	1000.1
352.06	22019.00	1000.6
352.06	23001.00	1001.2
352.06	24029.00	1001.8
352.06	24969.00	1002.3
361.90	1990.00	980.5
361.90	3001.00	981.2
361.90	4024.00	981.8
361.90	5019.00	982.5
361.90	6014.00	983.1
361.90	7025.00	983.7
361.90	8019.00	984.4
361.90	9010.00	985.0
361.90	9978.00	985.6
361.90	11019.00	986.3
361.90	12038.00	986.9
361.90	13020.00	987.6
361.90	14021.00	988.2
361.90	15006.00	988.8
361.90	15970.00	989.4
361.90	16988.00	990.1
361.90	17991.00	990.7
361.90	19016.00	991.4
361.90	20042.00	992.0
361.90	20983.00	992.6
361.90	22034.00	993.3
361.90	23021.00	993.9
361.90	24011.00	994.6
361.90	24912.00	995.1
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.68]	kPa	[370.97; 501.72]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.38350e+01
Coefficient B			-3.00508e+03
Coefficient C			-1.49150e+02
Temperature range, min.			370.97
Temperature range, max.			501.72
Pvap	1.33	kPa	370.97	Calculated Property
Pvap	3.07	kPa	385.50	Calculated Property
Pvap	6.40	kPa	400.03	Calculated Property
Pvap	12.33	kPa	414.55	Calculated Property
Pvap	22.20	kPa	429.08	Calculated Property
Pvap	37.70	kPa	443.61	Calculated Property
Pvap	60.91	kPa	458.14	Calculated Property
Pvap	94.27	kPa	472.66	Calculated Property
Pvap	140.52	kPa	487.19	Calculated Property
Pvap	202.68	kPa	501.72	Calculated Property
Pvap	[4.30e-03; 4580.17]	kPa	[285.39; 705.85]	KDB Vapor Pressure Data
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			1.62599e+02
Coefficient B			-1.39270e+04
Coefficient C			-2.12308e+01
Coefficient D			9.68027e-06
Temperature range, min.			285.39
Temperature range, max.			705.85
Pvap	4.30e-03	kPa	285.39	Calculated Property
Pvap	0.22	kPa	332.11	Calculated Property
Pvap	3.24	kPa	378.83	Calculated Property
Pvap	22.34	kPa	425.54	Calculated Property
Pvap	93.54	kPa	472.26	Calculated Property
Pvap	281.06	kPa	518.98	Calculated Property
Pvap	675.40	kPa	565.70	Calculated Property
Pvap	1396.14	kPa	612.41	Calculated Property
Pvap	2611.22	kPa	659.13	Calculated Property
Pvap	4580.17	kPa	705.85	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 3-methyl-.

Mixtures

• Phenol, 3-methyl- + Formamide, N,N-dimethyl-
• 3-Penten-2-one, 4-methyl- + Phenol, 3-methyl- + Water
• 2-Hexanone + Phenol, 3-methyl- + Water
• Phenol, 3-methyl- + 1,2-Ethanediol + Heptane
• Methyl Isobutyl Ketone + Phenol, 3-methyl- + Water
• Phenol, 3-methyl- + Ethanol
• Phenol, 3-methyl- + Methyl Alcohol
• 1-Propanol + Phenol, 3-methyl-
• Phenol, 3-methyl- + 2-Propanol
• Phenol, 3-methyl- + 1-Butanol
• Phenol, 3-methyl- + 1-Propanol, 2-methyl-
• 2-Propanol, 2-methyl- + Phenol, 3-methyl-
• Toluene + Phenol, 3-methyl- + 1,2-Ethanediol
• Phenol, 3-methyl- + Water
• Phenol, 3-methyl- + Benzaldehyde, 4-methoxy-
• Phenol, 3-methyl- + Phenol, 2,6-dimethyl-
• Phenol, 2-methyl- + Phenol, 3-methyl-
• Phenol, 3-methyl- + ETHANOL, 2,2'-IMINOBIS-
• 2-Butanone, 3-methyl- + Phenol, 3-methyl- + Water
• Phenol, 3-methyl- + 2-Pentanone + Water

Find more mixtures with Phenol, 3-methyl-.

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Excess Gibbs energies of binary mixtures formed by nitrobenzene with selected compounds at 94.95 kPa
• Excess Gibbs' energies of the binary mixtures formed by N,N-dimethylformamide with xylenes and cresols at 95.1 kPa
• Liquid-liquid equilibria in the ternary systems water + cresols + methyl butyl ketone at 298.2 and 313.2 K: experimental data and correlation
• Measurement of infinite dilution partition coefficients of isomeric benzene derivatives in [bmim][Tf2N]-CO2 biphasic system and correlation with the ePC-SAFT equation of state
• Liquid-liquid equilibria for the extraction of phenols from alkane using ethylene glycol
• Liquid-liquid equilibria for methyl isobutyl ketone + cresols + water at 333.15K, 343.15K and 353.15K: Experimental results and data correlation
• Determination and modeling of liquid-liquid equilibrium for ternary mixtures of methyl isopropyl ketone, cresol isomers and water
• Measurement, correlation and COSMO-SAC prediction of liquid-liquid equilibrium for the ternary systems, mesityl oxide + o-, m-, p-cresol + water, at 333.2 K and 353.2 K
• Phase equilibria of phenolic compounds in water or ethanol
• Measurement and correlation of isobaric vapour-liquid equilibrium for systems of o-cresol, m-cresol and 2, 6-dimethylphenol at 20.0 kPa
• Heat capacities of aqueous polar aromatic compounds over a wide range of conditions. Part I: phenol, cresols, aniline, and toluidines
• (Vapor + liquid) equilibria of the binary mixtures of m-cresol with C1 C4 aliphatic alcohols at 95.5 kPa
• Volumetric and ultrasonic behaviour of binary mixtures of 1-nonanol with o-cresol, m-cresol, p-cresol and anisole at T = (293.15 and 313.15) K
• Excess parameters of binary mixtures of anisaldehyde with o-cresol, m-cresol and p-cresol at T = (303.15, 308.15, 313.15, and 318.15) K
• Measurement and thermodynamic modeling of ternary (liquid + liquid) equilibrium for extraction of o-cresol, m-cresol or p-cresol from aqueous solution with 2-pentanone
• Liquid-liquid equilibria for toluene/heptane + phenol/cresols + ethylene glycol system
• Extraction of o-, m- and p-cresol from aqueous solution with methyl isopropyl ketone: Equilibrium, correlations, and COSMO-RS predictions
• Liquid-liquid equilibrium for methyl butyl ketone + o-, m-, p-cresol + water ternary systems and COSMO-SAC predictions
• Experimental and predicted vapor-liquid equilibrium for binary systems with diethanolamine, m-cresol and p-cresol at 20.0 kPa
• Solvent screening and liquid-liquid measurement for extraction of phenols from aromatic hydrocarbon mixtures
• Thermodynamic and spectroscopic study of molecular interactions between ethanol and isomeric cresols
• Phase Equilibrium Measurement and Thermodynamic Modeling of the 4-Methylpentan-2-one/3-Methylphenol, and 4-Methylphenol/Water Ternary Systems at 298.2, 313.2, and 323.2 K and 0.1 MPa
• Liquid Liquid Equilibrium for the Ternary Systems Methyl tert-Butyl Ketone + o-, m-, p-Cresol + Water at (298.2, 313.2, and 323.2) K
• Experimental and Predicted Vapor-Liquid Equilibrium for Diisopropanolamine with m-Cresol and 2,6-Dimethylphenol at 20.0 kPa
• Phase Equilibrium on Extraction Methylphenols from Aqueous Solution with 3,3-Dimethyl-2-butanone at 333.2 K and 353.2 K
• Activity Coefficients at Infinite Dilution and Excess Molar Volumes in Binary Mixtures Containing Normal Alkanes (Nonane, Decane, Undecane, or Dodecane) and Cresols (2-Methylphenol or 3-Methylphenol)
• Densities and Viscosities of Binary Mixtures of m-Cresol with Ethylene Glycol or Methanol over Several Temperatures
• Liquid-Liquid Equilibria in Ternary Systems of Aromatic Hydrocarbons (Toluene or Ethylbenzene) + Phenols + Water
• Densities, Speeds of Sound, and Refractive Indices of Binary Mixtures of Decan-1-ol with Anisole, o-Cresol, m-Cresol, and p-Cresol at T = (298.15, 303.15, and 308.15) K
• Henry's Law Constants and Infinite Dilution Activity Coefficients of Propane, Propene, Butane, 2-Methylpropane, 1-Butene, 2-Methylpropene, trans-2-Butene, cis-2-Butene, 1,3-Butadiene, Dimethyl Ether, Chloroethane, and 1,1-Difluoroethane in 2-Methylphenol, 3-Methylphenol, and 4-Methylphenol
• Liquid-Liquid(-Liquid) Equilibria in Ternary Systems of Aliphatic Hydrocarbons (Heptane or Octane) + Phenols + Water
• Vapor-Liquid Equilibria in Ternary Systems of Toluene or Octane + Phenols + Water
• Densities of Cresols and Linear Alkane Mixtures at High Pressure
• Experimental Densities and Speeds of Sound of Substituted Phenols and Their Modeling with the Prigogine Flory Patterson Model
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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