Chemical Properties of Benzene, (1-methylethyl)- (CAS 98-82-8)

InChI

InChI=1S/C9H12/c1-8(2)9-6-4-3-5-7-9/h3-8H,1-2H3

InChI Key

RWGFKTVRMDUZSP-UHFFFAOYSA-N

Formula

C9H12

SMILES

CC(C)c1ccccc1

Molecular Weight¹

120.19

CAS

98-82-8

Other Names

• (1-Methylethyl)benzene
• (1-methylethyl)benzene (cumene)
• (Methylethyl)benzene
• 1-methylethylbenzene
• 2-Fenilpropano
• 2-Fenyl-propaan
• 2-Phenylpropane
• Benzene, i-propyl-
• Benzene, isopropyl-
• Cumeen
• Cumol
• Isopropilbenzene
• Isopropylbenzeen
• Isopropylbenzol
• NSC 8776
• Propane, 2-phenyl-
• Rcra waste number U055
• UN 1918
• cumene
• i-Propylbenzene
• iso-propylbenzene
• iso-propylbenzene (cumene)
• isopropylbenzene

• ω : Acentric Factor.
• PAff : Proton affinity (kJ/mol).
• T_ig : Autoignition Temperature (K).
• 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).
• C_sat : Molar heat capacity at saturation pressure (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• LFL : Lower Flammability Limit (% in Air).
• UFL : Upper Flammability Limit (% in Air).
• T_flash,oc : Flash Point (Open Cup Method) (K).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• Δ_c,grossH : Heat of Combustion, Gross form (kJ/mol).
• Δ_c,netH : Heat of Combustion, Net Form (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.
• 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°_gas : Molar entropy at standard conditions (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).
• λ : Liquid thermal conductivity (W/m×K).
• T_fus : Normal melting (fusion) point (K).
• T_triple : Triple Point Temperature (K).
• V_c : Critical Volume (m³/kmol).
• Z_c : Critical Compressibility.
• Z_ra : Rackett Parameter.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Contents

1. Physical Properties
2. Temperature Dependent Properties
3. Datasets
4. Correlations
5. Similar Compounds
6. Mixtures
7. Sources

Physical Properties

Property	Value	Unit	Source
ω	0.3260		KDB
PAff	791.60	kJ/mol	NIST
Tig	698.15	K	KDB
BasG	763.90	kJ/mol	NIST
ΔcH°liquid	[-5218.60; -5215.44]	kJ/mol
ΔcH°liquid	-5215.44 ± 0.96	kJ/mol	NIST
ΔcH°liquid	-5218.60	kJ/mol	NIST
Cp,liquid	214.75	J/mol×K	Thermodynamics of mixtures involving some (benzene derivatives + benzonitrile)
η	[0.0007390; 0.0007390]	Pa×s
η	0.0007390	Pa×s	Viscosities, Densities, and Speeds of Sound of Binary Mixtures of o-Xylene, m-Xylene, p-Xylene, and Isopropylbenzene with 2-Butanone at 298.15 K
η	0.0007390	Pa×s	Viscosities, Densities, and Speeds of Sound of Binary Mixtures of o-Xylene, m-Xylene, p-Xylene, and Isopropylbenzene with 4-Methylpentan-2-one at 298.15 K
LFL	0.90	% in Air	KDB
UFL	6.50	% in Air	KDB
Tflash,oc	317.04	K	KDB
ΔfG°	137.10	kJ/mol	KDB
Δc,grossH	5215.44	kJ/mol	KDB
Δc,netH	4951.346	kJ/mol	KDB
ΔfH°gas	[3.90; 3.94]	kJ/mol
ΔfH°gas	3.94	kJ/mol	KDB
ΔfH°gas	3.90 ± 1.10	kJ/mol	NIST
ΔfH°liquid	-41.20 ± 1.10	kJ/mol	NIST
ΔfusH°	9.58	kJ/mol	Joback Calculated Property
ΔvapH°	[37.00; 45.15]	kJ/mol
ΔvapH°	45.15	kJ/mol	NIST
ΔvapH°	45.10	kJ/mol	NIST
ΔvapH°	45.10 ± 0.10	kJ/mol	NIST
ΔvapH°	44.00	kJ/mol	NIST
ΔvapH°	45.10	kJ/mol	NIST
ΔvapH°	Outlier 37.00	kJ/mol	NIST
ΔvapH°	45.10	kJ/mol	NIST
ΔvapH°	45.14	kJ/mol	NIST
ΔvapH°	45.10	kJ/mol	NIST
IE	[8.69; 8.98]	eV
IE	8.73 ± 0.02	eV	NIST
IE	8.72	eV	NIST
IE	8.72 ± 0.01	eV	NIST
IE	8.69 ± 0.01	eV	NIST
IE	8.76	eV	NIST
IE	8.71	eV	NIST
IE	8.75	eV	NIST
IE	Outlier 8.98	eV	NIST
log10WS	[-3.27; -3.27]
log10WS	-3.27		Aq. Solubility Prediction
log10WS	-3.27		Estimated Solubility
logPoct/wat	2.810		Crippen Calculated Property
McVol	113.910	ml/mol	McGowan Calculated Property
NFPA Fire	2		KDB
Pc	[2786.44; 3210.00]	kPa
Pc	3209.00	kPa	KDB
Pc	3210.00 ± 40.00	kPa	NIST
Pc	3209.00 ± 6.00	kPa	NIST
Pc	2786.44 ± 151.99	kPa	NIST
Pc	3160.00 ± 5.88	kPa	NIST
ρc	278.84 ± 0.96	kg/m3	NIST
Inp	[134.00; 961.00]
Inp	909.10		NIST
Inp	909.82		NIST
Inp	930.00		NIST
Inp	930.00		NIST
Inp	935.10		NIST
Inp	942.50		NIST
Inp	908.00		NIST
Inp	909.00		NIST
Inp	909.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.50		NIST
Inp	919.20		NIST
Inp	920.10		NIST
Inp	920.70		NIST
Inp	919.00		NIST
Inp	920.00		NIST
Inp	892.90		NIST
Inp	898.20		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	919.00		NIST
Inp	920.00		NIST
Inp	919.00		NIST
Inp	922.00		NIST
Inp	916.00		NIST
Inp	907.00		NIST
Inp	905.00		NIST
Inp	909.30		NIST
Inp	909.80		NIST
Inp	911.30		NIST
Inp	921.00		NIST
Inp	929.00		NIST
Inp	915.00		NIST
Inp	920.00		NIST
Inp	926.00		NIST
Inp	932.00		NIST
Inp	904.10		NIST
Inp	906.70		NIST
Inp	920.40		NIST
Inp	925.60		NIST
Inp	931.80		NIST
Inp	915.50		NIST
Inp	900.30		NIST
Inp	907.00		NIST
Inp	903.40		NIST
Inp	903.90		NIST
Inp	904.10		NIST
Inp	904.10		NIST
Inp	906.70		NIST
Inp	908.00		NIST
Inp	939.00		NIST
Inp	939.00		NIST
Inp	939.00		NIST
Inp	902.00		NIST
Inp	902.00		NIST
Inp	901.00		NIST
Inp	922.00		NIST
Inp	927.00		NIST
Inp	930.00		NIST
Inp	932.00		NIST
Inp	929.00		NIST
Inp	932.00		NIST
Inp	935.00		NIST
Inp	937.00		NIST
Inp	940.00		NIST
Inp	910.10		NIST
Inp	910.10		NIST
Inp	910.10		NIST
Inp	910.10		NIST
Inp	910.10		NIST
Inp	910.10		NIST
Inp	908.00		NIST
Inp	905.00		NIST
Inp	908.00		NIST
Inp	911.00		NIST
Inp	913.00		NIST
Inp	916.00		NIST
Inp	915.00		NIST
Inp	903.10		NIST
Inp	910.80		NIST
Inp	903.50		NIST
Inp	932.00		NIST
Inp	940.00		NIST
Inp	947.00		NIST
Inp	924.00		NIST
Inp	909.00		NIST
Inp	915.00		NIST
Inp	932.00		NIST
Inp	925.10		NIST
Inp	917.00		NIST
Inp	909.00		NIST
Inp	927.00		NIST
Inp	911.00		NIST
Inp	912.20		NIST
Inp	912.00		NIST
Inp	910.00		NIST
Inp	927.00		NIST
Inp	914.30		NIST
Inp	919.40		NIST
Inp	922.20		NIST
Inp	923.60		NIST
Inp	906.90		NIST
Inp	930.30		NIST
Inp	929.00		NIST
Inp	926.00		NIST
Inp	910.80		NIST
Inp	928.70		NIST
Inp	907.20		NIST
Inp	907.90		NIST
Inp	919.40		NIST
Inp	922.20		NIST
Inp	923.60		NIST
Inp	913.00		NIST
Inp	909.43		NIST
Inp	909.62		NIST
Inp	910.00		NIST
Inp	934.30		NIST
Inp	929.20		NIST
Inp	931.60		NIST
Inp	946.50		NIST
Inp	941.60		NIST
Inp	944.90		NIST
Inp	920.00		NIST
Inp	914.90		NIST
Inp	909.07		NIST
Inp	910.70		NIST
Inp	906.00		NIST
Inp	905.10		NIST
Inp	911.30		NIST
Inp	909.00		NIST
Inp	925.00		NIST
Inp	936.10		NIST
Inp	910.00		NIST
Inp	923.00		NIST
Inp	932.00		NIST
Inp	918.00		NIST
Inp	919.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	925.00		NIST
Inp	926.00		NIST
Inp	903.00		NIST
Inp	917.00		NIST
Inp	903.00		NIST
Inp	910.00		NIST
Inp	950.00		NIST
Inp	925.00		NIST
Inp	916.00		NIST
Inp	922.00		NIST
Inp	912.00		NIST
Inp	923.00		NIST
Inp	926.00		NIST
Inp	915.00		NIST
Inp	929.00		NIST
Inp	932.00		NIST
Inp	915.00		NIST
Inp	923.00		NIST
Inp	956.00		NIST
Inp	954.00		NIST
Inp	925.00		NIST
Inp	927.00		NIST
Inp	926.00		NIST
Inp	919.00		NIST
Inp	956.00		NIST
Inp	912.00		NIST
Inp	908.00		NIST
Inp	930.70		NIST
Inp	926.00		NIST
Inp	916.00		NIST
Inp	906.00		NIST
Inp	938.00		NIST
Inp	961.00		NIST
Inp	910.00		NIST
Inp	915.00		NIST
Inp	916.00		NIST
Inp	914.00		NIST
Inp	924.00		NIST
Inp	927.00		NIST
Inp	931.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	919.00		NIST
Inp	920.00		NIST
Inp	922.00		NIST
Inp	922.00		NIST
Inp	923.00		NIST
Inp	920.00		NIST
Inp	920.00		NIST
Inp	909.00		NIST
Inp	914.00		NIST
Inp	925.00		NIST
Inp	914.00		NIST
Inp	923.00		NIST
Inp	911.00		NIST
Inp	920.00		NIST
Inp	919.00		NIST
Inp	914.00		NIST
Inp	908.00		NIST
Inp	919.00		NIST
Inp	908.00		NIST
Inp	912.00		NIST
Inp	925.00		NIST
Inp	905.00		NIST
Inp	907.50		NIST
Inp	933.00		NIST
Inp	906.00		NIST
Inp	913.00		NIST
Inp	915.00		NIST
Inp	921.00		NIST
Inp	905.00		NIST
Inp	919.00		NIST
Inp	929.00		NIST
Inp	904.00		NIST
Inp	929.00		NIST
Inp	Outlier 134.00		NIST
I	[1150.00; 1236.00]
I	1158.00		NIST
I	1176.90		NIST
I	1202.10		NIST
I	1203.60		NIST
I	1169.80		NIST
I	1154.90		NIST
I	Outlier 1232.00		NIST
I	Outlier 1236.00		NIST
I	1198.00		NIST
I	1205.00		NIST
I	1213.00		NIST
I	1191.00		NIST
I	1161.00		NIST
I	1182.00		NIST
I	1192.30		NIST
I	1177.00		NIST
I	1181.00		NIST
I	1166.00		NIST
I	1186.00		NIST
I	1189.00		NIST
I	1200.00		NIST
I	1211.00		NIST
I	Outlier 1225.00		NIST
I	1169.00		NIST
I	1179.00		NIST
I	1155.00		NIST
I	1168.00		NIST
I	1185.00		NIST
I	1168.00		NIST
I	1172.00		NIST
I	1150.00		NIST
I	1171.00		NIST
I	1183.00		NIST
I	1155.00		NIST
I	1182.00		NIST
I	1177.00		NIST
I	1182.00		NIST
I	1164.00		NIST
I	1161.00		NIST
I	1162.00		NIST
I	1186.00		NIST
I	1169.00		NIST
S°gas	386.53	J/mol×K	NIST
S°liquid	277.57	J/mol×K	NIST
Tboil	[152.40; 428.30]	K
Tboil	425.55	K	Isobaric (vapour + liquid) equilibria for sulfolane with toluene, ethylbenzene, and isopropylbenzene at 101.33 kPa
Tboil	425.55	K	Isobaric (vapour + liquid) equilibria for N-formylmorpholine with ethylbenzene, n-butylbenzene, iso-propylbenzene and 1,2,4-trimethylbenzene at 101.33 kPa
Tboil	425.44	K	Isobaric Vapor Liquid Equilibrium of Binary Mixtures of Vinyl Acetate and Ethyl Formate with Cumene at 97.3 kPa
Tboil	425.63	K	Experimental Isobaric Vapor-Liquid Equilibrium Data for Binary Mixtures of Cyclic Ethers with (1-Methylethyl)benzene
Tboil	425.44	K	Vapor-Liquid Equilibrium Data for N-Methylacetamide and N,N-Dimethylacetamide with Cumene at 97.3 kPa
Tboil	425.56	K	KDB
Tboil	425.54 ± 0.15	K	NIST
Tboil	425.54 ± 0.20	K	NIST
Tboil	425.60	K	NIST
Tboil	Outlier 152.40 ± 0.30	K	NIST
Tboil	405.20 ± 0.40	K	NIST
Tboil	408.15 ± 6.00	K	NIST
Tboil	425.55 ± 0.20	K	NIST
Tboil	424.35 ± 0.40	K	NIST
Tboil	425.00 ± 2.00	K	NIST
Tboil	424.00 ± 3.00	K	NIST
Tboil	424.75 ± 0.40	K	NIST
Tboil	425.00 ± 3.00	K	NIST
Tboil	425.60 ± 0.70	K	NIST
Tboil	424.00 ± 3.00	K	NIST
Tboil	425.60 ± 0.30	K	NIST
Tboil	425.60 ± 0.25	K	NIST
Tboil	425.00 ± 2.00	K	NIST
Tboil	425.00 ± 3.00	K	NIST
Tboil	426.00 ± 5.00	K	NIST
Tboil	425.00 ± 2.00	K	NIST
Tboil	425.59 ± 0.30	K	NIST
Tboil	424.00 ± 2.00	K	NIST
Tboil	423.00 ± 2.00	K	NIST
Tboil	424.90 ± 0.70	K	NIST
Tboil	425.00 ± 4.00	K	NIST
Tboil	425.60 ± 0.60	K	NIST
Tboil	425.54 ± 0.03	K	NIST
Tboil	423.00 ± 4.00	K	NIST
Tboil	425.65 ± 2.00	K	NIST
Tboil	425.57 ± 0.20	K	NIST
Tboil	425.45 ± 0.30	K	NIST
Tboil	424.00 ± 4.00	K	NIST
Tboil	425.55 ± 0.30	K	NIST
Tboil	425.45 ± 0.02	K	NIST
Tboil	425.57 ± 0.15	K	NIST
Tboil	424.00 ± 3.00	K	NIST
Tboil	426.00 ± 3.00	K	NIST
Tboil	427.90 ± 0.30	K	NIST
Tboil	425.55 ± 0.07	K	NIST
Tboil	425.00 ± 3.00	K	NIST
Tboil	425.60 ± 0.20	K	NIST
Tboil	425.54 ± 0.06	K	NIST
Tboil	Outlier 273.15 ± 1.50	K	NIST
Tboil	425.45 ± 0.20	K	NIST
Tboil	425.75 ± 0.25	K	NIST
Tboil	426.00 ± 3.00	K	NIST
Tboil	424.15 ± 1.50	K	NIST
Tboil	425.55 ± 0.20	K	NIST
Tboil	425.54 ± 0.06	K	NIST
Tboil	425.53 ± 0.06	K	NIST
Tboil	425.00 ± 3.00	K	NIST
Tboil	425.05 ± 0.50	K	NIST
Tboil	424.00 ± 3.00	K	NIST
Tboil	426.00 ± 4.00	K	NIST
Tboil	425.65 ± 2.00	K	NIST
Tboil	424.00 ± 3.00	K	NIST
Tboil	425.15 ± 0.60	K	NIST
Tboil	425.67 ± 0.20	K	NIST
Tboil	428.30 ± 3.00	K	NIST
Tboil	426.30 ± 1.00	K	NIST
Tboil	426.00 ± 3.00	K	NIST
Tboil	425.00 ± 2.00	K	NIST
Tboil	426.10 ± 0.50	K	NIST
Tboil	426.00 ± 2.00	K	NIST
Tc	[624.55; 635.90]	K
Tc	631.00	K	KDB
Tc	631.00 ± 0.50	K	NIST
Tc	631.10 ± 0.15	K	NIST
Tc	624.55 ± 2.00	K	NIST
Tc	635.90 ± 4.00	K	NIST
Tfus	[176.47; 177.95]	K
Tfus	177.14	K	KDB
Tfus	177.11 ± 0.30	K	NIST
Tfus	176.69 ± 0.40	K	NIST
Tfus	177.10 ± 0.02	K	NIST
Tfus	177.13 ± 0.07	K	NIST
Tfus	176.47 ± 0.50	K	NIST
Tfus	177.18 ± 0.20	K	NIST
Tfus	Outlier 177.95 ± 0.40	K	NIST
Tfus	176.69 ± 0.20	K	NIST
Tfus	176.95 ± 0.30	K	NIST
Tfus	177.05 ± 0.30	K	NIST
Tfus	176.69 ± 0.15	K	NIST
Tfus	176.90 ± 0.06	K	NIST
Tfus	176.99 ± 0.04	K	NIST
Ttriple	[177.13; 177.13]	K
Ttriple	177.13 ± 0.01	K	NIST
Ttriple	177.13 ± 0.01	K	NIST
Vc	0.435	m3/kmol	KDB
Zc	0.2658850		KDB
Zra	0.26		KDB

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[214.82; 289.96]	J/mol×K	[431.56; 643.71]
Cp,gas	214.82	J/mol×K	431.56	Joback Calculated Property
Cp,gas	229.30	J/mol×K	466.92	Joback Calculated Property
Cp,gas	242.96	J/mol×K	502.28	Joback Calculated Property
Cp,gas	255.82	J/mol×K	537.64	Joback Calculated Property
Cp,gas	267.92	J/mol×K	573.00	Joback Calculated Property
Cp,gas	279.29	J/mol×K	608.35	Joback Calculated Property
Cp,gas	289.96	J/mol×K	643.71	Joback Calculated Property
Cp,liquid	[198.70; 215.40]	J/mol×K	[295.96; 302.00]
Cp,liquid	214.40	J/mol×K	295.96	NIST
Cp,liquid	213.00	J/mol×K	298.00	NIST
Cp,liquid	215.40	J/mol×K	298.15	NIST
Cp,liquid	209.41	J/mol×K	299.80	NIST
Cp,liquid	198.70	J/mol×K	302.00	NIST
Cp,liquid	198.70	J/mol×K	302.00	NIST
Csat	[229.10; 259.50]	J/mol×K	[332.20; 401.30]
Csat	229.10	J/mol×K	332.20	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	234.20	J/mol×K	342.10	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	238.50	J/mol×K	354.90	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	242.50	J/mol×K	361.80	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	246.70	J/mol×K	371.60	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	251.10	J/mol×K	381.50	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	255.20	J/mol×K	391.40	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
Csat	259.50	J/mol×K	401.30	Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
η	[0.0006110; 0.0006900]	Pa×s	[303.15; 313.15]
η	0.0006900	Pa×s	303.15	Physical Properties of Binary Mixtures of Ethyl Formate with Benzene, Isopropyl Benzene, Isobutyl Benzene, and Butylbenzene at (303.15, 308.15, and 313.15) K
η	0.0006900	Pa×s	303.15	Density and Viscosity of Propyl Formate + Aromatic Hydrocarbons at T = (303.15, 308.15, and 313.15) K
η	0.0006510	Pa×s	308.15	Physical Properties of Binary Mixtures of Ethyl Formate with Benzene, Isopropyl Benzene, Isobutyl Benzene, and Butylbenzene at (303.15, 308.15, and 313.15) K
η	0.0006510	Pa×s	308.15	Density and Viscosity of Propyl Formate + Aromatic Hydrocarbons at T = (303.15, 308.15, and 313.15) K
η	0.0006110	Pa×s	313.15	Physical Properties of Binary Mixtures of Ethyl Formate with Benzene, Isopropyl Benzene, Isobutyl Benzene, and Butylbenzene at (303.15, 308.15, and 313.15) K
η	0.0006110	Pa×s	313.15	Density and Viscosity of Propyl Formate + Aromatic Hydrocarbons at T = (303.15, 308.15, and 313.15) K
ΔfusH	[7.32; 7.33]	kJ/mol	[177.10; 177.13]
ΔfusH	7.32	kJ/mol	177.10	NIST
ΔfusH	7.32	kJ/mol	177.10	NIST
ΔfusH	7.32	kJ/mol	177.10	NIST
ΔfusH	7.32	kJ/mol	177.10	NIST
ΔfusH	7.33	kJ/mol	177.13	NIST
ΔfusH	7.33	kJ/mol	177.13	NIST
ΔvapH	[41.20; 42.10]	kJ/mol	[384.50; 387.50]
ΔvapH	41.90	kJ/mol	384.50	NIST
ΔvapH	42.10	kJ/mol	386.00	NIST
ΔvapH	41.20	kJ/mol	387.50	NIST
n0	[1.48869; 1.49130]		[293.15; 298.20]
n0	1.49130		293.15	Liquid liquid equilibria of ternary systems (water + carboxylic acid + cumene) at 298.15K
n0	1.49120		293.15	Experimental and correlational study of phase equilibria in aqueous mixtures of phosphoric acid with aromatic hydrocarbons at various temperatures
n0	1.48869		298.15	Effect of Temperature on the Change of Refractive Index on Mixing for Butyl Acetate + Aromatic Hydrocarbons
n0	1.48890		298.15	KDB
n0	1.49005		298.20	Salt Effects on Liquid-Liquid Equilibria of Water + Phenol + (Propan-2-yl) Benzene + Salts Systems
ρl	[857.51; 864.12]	kg/m3	[293.00; 298.20]
ρl	862.00	kg/m3	293.00	KDB
ρl	857.51	kg/m3	298.15	Thermodynamic study of 1,1,2,2-tetrachloroethane + hydrocarbon mixtures I. Excess and solvation enthalpies
ρl	864.12	kg/m3	298.15	Liquid-Liquid Equilibrium for Ternary Systems, Water + 5-Hydroxymethylfurfural + (1-Butanol, Isobutanol, Methyl Isobutyl Ketone), at 313.15, 323.15, and 333.15 K
ρl	857.54	kg/m3	298.20	Liquid-Liquid Equilibrium of the Ternary System of Water + Phenol + (Propan-2-yl) Benzene at Several Temperatures
ΔfusS	[41.36; 41.37]	J/mol×K	[177.10; 177.13]
ΔfusS	41.37	J/mol×K	177.10	NIST
ΔfusS	41.37	J/mol×K	177.10	NIST
ΔfusS	41.36	J/mol×K	177.13	NIST
ΔfusS	41.36	J/mol×K	177.13	NIST
γ	0.03	N/m	293.20	KDB
λ	[0.11; 0.13]	W/m×K	[261.13; 329.83]
λ	0.13	W/m×K	261.13	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.13	W/m×K	261.33	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.13	W/m×K	261.48	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	275.03	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	275.24	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	275.40	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	294.11	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	294.32	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	294.47	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	312.46	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	312.68	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.12	W/m×K	312.84	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.11	W/m×K	329.45	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.11	W/m×K	329.68	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
λ	0.11	W/m×K	329.83	Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons

Datasets

1. Mass density, kg/m3 (1)
2. Speed of sound, m/s (1)

Mass density, kg/m3

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Mass density, kg/m3 - Liquid
298.15	100.00	857.94
313.15	100.00	845.05
333.15	100.00	827.73
353.15	100.00	810.17
373.15	100.00	792.31
393.15	100.00	773.98
413.15	100.00	755.04
433.15	10100.00	752.29
298.15	20100.00	871.79
313.15	20100.00	859.97
333.15	20100.00	844.44
353.15	20100.00	828.86
373.15	20100.00	813.36
393.15	20100.00	797.74
413.15	20100.00	781.98
433.15	20100.00	766.12
298.15	40100.00	883.81
313.15	40100.00	872.84
333.15	40100.00	858.51
353.15	40100.00	844.27
373.15	40100.00	830.23
393.15	40100.00	816.2
413.15	40100.00	802.25
433.15	40100.00	788.34
298.15	60100.00	894.47
313.15	60100.00	884.19
333.15	60100.00	870.78
353.15	60100.00	857.52
373.15	60100.00	844.51
393.15	60100.00	831.6
413.15	60100.00	818.85
433.15	60100.00	806.14
298.15	80100.00	904.16
313.15	80100.00	894.38
333.15	80100.00	881.68
353.15	80100.00	869.22
373.15	80100.00	857.0
393.15	80100.00	844.92
413.15	80100.00	833.04
433.15	80100.00	821.27
298.15	100100.00	913.02
313.15	100100.00	903.69
333.15	100100.00	891.56
353.15	100100.00	879.74
373.15	100100.00	868.11
393.15	100100.00	856.72
413.15	100100.00	845.53
433.15	100100.00	834.45
Reference

Speed of sound, m/s

Operational condition: Frequency, MHz = 3 (Liquid)

Fixed		Measured
Temperature, K - Liquid	Pressure, kPa - Liquid	Speed of sound, m/s - Liquid
298.15	100.00	1309.1
313.15	100.00	1247.6
333.15	100.00	1168.5
353.15	100.00	1091.8
373.15	100.00	1017.8
393.15	100.00	945.6
413.15	100.00	875.0
433.15	10100.00	897.7
298.15	20100.00	1406.9
313.15	20100.00	1351.3
333.15	20100.00	1280.5
353.15	20100.00	1213.2
373.15	20100.00	1149.2
393.15	20100.00	1088.1
413.15	20100.00	1029.6
433.15	20100.00	974.0
298.15	40100.00	1491.7
313.15	40100.00	1440.0
333.15	40100.00	1374.7
353.15	40100.00	1313.2
373.15	40100.00	1255.1
393.15	40100.00	1200.1
413.15	40100.00	1147.8
433.15	40100.00	1098.9
298.15	60100.00	1566.8
313.15	60100.00	1518.3
333.15	60100.00	1457.2
353.15	60100.00	1399.6
373.15	60100.00	1345.6
393.15	60100.00	1294.7
413.15	60100.00	1246.5
433.15	60100.00	1201.3
298.15	80100.00	1634.8
313.15	80100.00	1588.9
333.15	80100.00	1530.9
353.15	80100.00	1476.5
373.15	80100.00	1425.6
393.15	80100.00	1377.6
413.15	80100.00	1332.1
433.15	80100.00	1289.9
298.15	100100.00	1697.4
313.15	100100.00	1653.3
333.15	100100.00	1598.0
353.15	100100.00	1546.0
373.15	100100.00	1497.4
393.15	100100.00	1451.6
413.15	100100.00	1408.6
433.15	100100.00	1368.6
Reference

Correlations

Property	Value	Unit	Temperature (K)	Source
Pvap	[1.33; 202.66]	kPa	[310.56; 454.20]	The Yaws Handbook of Vapor Pressure
Equation			ln(Pvp) = A + B/(T + C)
Coefficient A			1.43493e+01
Coefficient B			-3.63341e+03
Coefficient C			-5.21730e+01
Temperature range, min.			310.56
Temperature range, max.			454.20
Pvap	1.33	kPa	310.56	Calculated Property
Pvap	3.02	kPa	326.52	Calculated Property
Pvap	6.26	kPa	342.48	Calculated Property
Pvap	12.01	kPa	358.44	Calculated Property
Pvap	21.61	kPa	374.40	Calculated Property
Pvap	36.80	kPa	390.36	Calculated Property
Pvap	59.72	kPa	406.32	Calculated Property
Pvap	92.95	kPa	422.28	Calculated Property
Pvap	139.48	kPa	438.24	Calculated Property
Pvap	202.66	kPa	454.20	Calculated Property
Pvap	[3.82e-07; 3143.15]	kPa	[177.14; 631.15]	KDB Vapor Pressure Data
Equation			ln(Pvp) = A + B/T + C*ln(T) + D*T^2
Coefficient A			1.02480e+02
Coefficient B			-8.96989e+03
Coefficient C			-1.29151e+01
Coefficient D			7.67090e-06
Temperature range, min.			177.14
Temperature range, max.			631.15
Pvap	3.82e-07	kPa	177.14	Calculated Property
Pvap	1.32e-03	kPa	227.59	Calculated Property
Pvap	0.15	kPa	278.03	Calculated Property
Pvap	3.20	kPa	328.48	Calculated Property
Pvap	25.23	kPa	378.92	Calculated Property
Pvap	110.81	kPa	429.37	Calculated Property
Pvap	337.42	kPa	479.81	Calculated Property
Pvap	812.07	kPa	530.26	Calculated Property
Pvap	1677.90	kPa	580.70	Calculated Property
Pvap	3143.15	kPa	631.15	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (1-methylethyl)-.

Mixtures

• Benzene, (1-methylethyl)- + Pentane
• n-Hexane + Benzene, (1-methylethyl)-
• Benzene, (1-methylethyl)- + risperidone
• Benzene, (1-methylethyl)- + Water + Phosphoric Acid
• Benzene, (1-methylethyl)- + Water
• Benzene, (1-methylethyl)- + Benzonitrile
• Benzene, (1-methylethyl)- + Thiophene, tetrahydro-, 1,1-dioxide
• Benzene, (1-methylethyl)- + Ethane, 1,1,2,2-tetrachloro-
• Benzene, (1-methylethyl)- + N-Formylmorpholine
• Benzene, (1-methylethyl)- + Formic acid + Water
• Benzene, (1-methylethyl)- + Acetic acid + Water
• Benzene, (1-methylethyl)- + Propanoic acid + Water
• Benzene, (1-methylethyl)- + Acetic acid, butyl ester
• Ethyl formate + Benzene, (1-methylethyl)-
• Benzene, (1-methylethyl)- + Acetic acid ethenyl ester
• Methyl Isobutyl Ketone + Benzene, (1-methylethyl)-
• Benzene, (1-methylethyl)- + Cyclohexane + Thiophene, tetrahydro-, 1,1-dioxide
• Benzene, (1-methylethyl)- + Acetone + Water
• Benzene, (1-methylethyl)- + Propanoic acid, 2-methyl- + Water
• Benzene, (1-methylethyl)- + Acetamide, N-methyl-

Find more mixtures with Benzene, (1-methylethyl)-.

Sources

• KDB Vapor Pressure Data
• Crippen Method
• Effect of Temperature on the Change of Refractive Index on Mixing for Butyl Acetate + Aromatic Hydrocarbons
• Liquid liquid equilibria of ternary systems (water + carboxylic acid + cumene) at 298.15K
• Thermodynamic study of 1,1,2,2-tetrachloroethane + hydrocarbon mixtures I. Excess and solvation enthalpies
• Thermodynamics of risperidone and solubility in pure organic solvents
• Study of critical and maximum temperatures of coexistence of liquid and gas phase in hydrocarbons binary mixtures of aromatic hydrocarbons with alkanes and cycloalkanes
• 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
• Liquid density measurements of cumene, tert-butylbenzene, and hexadecane over wide ranges of temperature and pressure
• 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 mixtures involving some (benzene derivatives + benzonitrile)
• LLE data for the ionic liquid 3-methyl-N-butyl pyridinium dicyanamide with several aromatic and aliphatic hydrocarbons
• Isobaric (vapour + liquid) equilibria for sulfolane with toluene, ethylbenzene, and isopropylbenzene at 101.33 kPa
• Isobaric (vapour + liquid) equilibria for N-formylmorpholine with ethylbenzene, n-butylbenzene, iso-propylbenzene and 1,2,4-trimethylbenzene at 101.33 kPa
• 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
• Experimental and correlational study of phase equilibria in aqueous mixtures of phosphoric acid with aromatic hydrocarbons at various temperatures
• 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
• 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
• Thermodynamic properties of cumene, tert-butylbenzene, and n-hexadecane under elevated pressures
• Liquid-Liquid Equilibrium of the Ternary System of Water + Phenol + (Propan-2-yl) Benzene at Several Temperatures
• Liquid-Liquid Equilibrium for Ternary Systems, Water + 5-Hydroxymethylfurfural + (1-Butanol, Isobutanol, Methyl Isobutyl Ketone), at 313.15, 323.15, and 333.15 K
• Salt Effects on Liquid-Liquid Equilibria of Water + Phenol + (Propan-2-yl) Benzene + Salts Systems
• Thermal Conductivity and Thermal Diffusivity of Twenty-Nine Liquids: Alkenes, Cyclic (Alkanes, Alkenes, Alkadienes, Aromatics), and Deuterated Hydrocarbons
• Viscosities, Densities, and Speeds of Sound of Binary Mixtures of o-Xylene, m-Xylene, p-Xylene, and Isopropylbenzene with 2-Butanone at 298.15 K
• Viscosities, Densities, and Speeds of Sound of Binary Mixtures of o-Xylene, m-Xylene, p-Xylene, and Isopropylbenzene with 4-Methylpentan-2-one at 298.15 K
• Saturated Heat Capacities of Some Linear and Branched Alkylbenzenes between (332 and 401) K
• Liquid-Liquid Equilibrium of (Water + Acetone) with Cumene or r-Methylstyrene or Phenol at Temperatures of (323.15 and 333.15) K
• Liquid-Liquid Equilibria of Ternary and Six-Component Systems Including Cyclohexane, Benzene, Toluene, Ethylbenzene, Cumene, and Sulfolane at 303.15 K
• Vapor-Liquid Equilibrium for Benzaldehyde with 1-Methylethylbenzene and for 2-Methyl-propan-2-ol with 2,4,4-Trimethyl-1-pentene
• Salting-Out Effect of NaCl and KCl on the Liquid Liquid Equilibrium of Water + 2-Methylpropanoic Acid + (1-Methylethyl)-benzene System at Several Temperatures
• Determination of Henry's Law Constants Using Internal Standards with Benchmark Values
• Isobaric Vapor Liquid Equilibrium of Binary Mixtures of Vinyl Acetate and Ethyl Formate with Cumene at 97.3 kPa
• Experimental Isobaric Vapor-Liquid Equilibrium Data for Binary Mixtures of Cyclic Ethers with (1-Methylethyl)benzene
• Vapor-Liquid Equilibrium Data for N-Methylacetamide and N,N-Dimethylacetamide with Cumene at 97.3 kPa
• Physical Properties of Binary Mixtures of Ethyl Formate with Benzene, Isopropyl Benzene, Isobutyl Benzene, and Butylbenzene at (303.15, 308.15, and 313.15) K
• Density and Viscosity of Propyl Formate + Aromatic Hydrocarbons at T = (303.15, 308.15, and 313.15) K
• Joback Method
• KDB
• Aqueous Solubility Prediction Method
• Estimated Solubility Method
• McGowan Method
• NIST Webbook
• The Yaws Handbook of Vapor Pressure

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