Chemical Properties of Benzene, 2-chloro-1-methyl-4-(1-methylethyl)- (CAS 4395-79-3)

InChI

InChI=1S/C10H13Cl/c1-7(2)9-5-4-8(3)10(11)6-9/h4-7H,1-3H3

InChI Key

JVIGKRUGGYKFSL-UHFFFAOYSA-N

Formula

C10H13Cl

SMILES

Cc1ccc(C(C)C)cc1Cl

Molecular Weight¹

168.66

CAS

4395-79-3

Other Names

• 2-Chloro-4-isopropyltoluene
• 2-Chlorocymol
• Carvacryl chloride
• Septol
• p-Cymene, 2-chloro-

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• T_boil : Normal Boiling Point Temperature (K).
• T_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[178.55; 419.44]	J/mol×K	[273.00; 1000.00]	Joback Predicted correlation
Equation			Y = A + B·T + C·T² + D·T³ + E·T⁴ Y is Cp,gas in J/mol×K, T in K
Coefficient A			-3.00000e-01
Coefficient B			7.68660e-01
Coefficient C			-4.40920e-04
Coefficient D			9.20000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	178.55	J/mol×K	273.00	Calculated Property
Cp,gas	220.52	J/mol×K	353.78	Calculated Property
Cp,gas	258.01	J/mol×K	434.56	Calculated Property
Cp,gas	291.31	J/mol×K	515.33	Calculated Property
Cp,gas	320.71	J/mol×K	596.11	Calculated Property
Cp,gas	346.51	J/mol×K	676.89	Calculated Property
Cp,gas	368.99	J/mol×K	757.67	Calculated Property
Cp,gas	388.44	J/mol×K	838.44	Calculated Property
Cp,gas	405.16	J/mol×K	919.22	Calculated Property
Cp,gas	419.44	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0023579; 0.0002105]	Pa×s	[268.84; 504.03]	Joback Predicted correlation
Equation			Y = exp(A + B/T + C·ln(T) + D·T^E) Y is η in Pa×s, T in K
Coefficient A			-1.12281e+01
Coefficient B			1.39208e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			268.84
Temperature range, max.			504.03
η	0.0023579	Pa×s	268.84	Calculated Property
η	0.0014904	Pa×s	294.97	Calculated Property
η	0.0010151	Pa×s	321.10	Calculated Property
η	0.0007325	Pa×s	347.24	Calculated Property
η	0.0005533	Pa×s	373.37	Calculated Property
η	0.0004335	Pa×s	399.50	Calculated Property
η	0.0003500	Pa×s	425.63	Calculated Property
η	0.0002897	Pa×s	451.76	Calculated Property
η	0.0002448	Pa×s	477.89	Calculated Property
η	0.0002105	Pa×s	504.03	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, 2-chloro-1-methyl-4-(1-methylethyl)-.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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