Chemical Properties of Benzene, 2-methyl-1,4-bis(1-methylethyl)- (CAS 58502-85-5)

InChI

InChI=1S/C13H20/c1-9(2)12-6-7-13(10(3)4)11(5)8-12/h6-10H,1-5H3

InChI Key

BRXCOIOOGGCKPZ-UHFFFAOYSA-N

Formula

C13H20

SMILES

Cc1cc(C(C)C)ccc1C(C)C

Molecular Weight¹

176.30

CAS

58502-85-5

Other Names

• 1,4-Diisopropyl-2-methylbenzene

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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).
• 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).
• I_np : Non-polar retention indices.
• 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

Cheméo can also estimate Standard Gibbs free energy of formation for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[228.48; 566.48]	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			-1.76000e+01
Coefficient B			1.05280e+00
Coefficient C			-5.86920e-04
Coefficient D			1.18200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	228.48	J/mol×K	273.00	Calculated Property
Cp,gas	286.63	J/mol×K	353.78	Calculated Property
Cp,gas	338.77	J/mol×K	434.56	Calculated Property
Cp,gas	385.25	J/mol×K	515.33	Calculated Property
Cp,gas	426.46	J/mol×K	596.11	Calculated Property
Cp,gas	462.77	J/mol×K	676.89	Calculated Property
Cp,gas	494.56	J/mol×K	757.67	Calculated Property
Cp,gas	522.19	J/mol×K	838.44	Calculated Property
Cp,gas	546.04	J/mol×K	919.22	Calculated Property
Cp,gas	566.48	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0035478; 0.0001756]	Pa×s	[257.73; 518.25]	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			-1.16208e+01
Coefficient B			1.54106e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			257.73
Temperature range, max.			518.25
η	0.0035478	Pa×s	257.73	Calculated Property
η	0.0019397	Pa×s	286.68	Calculated Property
η	0.0011848	Pa×s	315.62	Calculated Property
η	0.0007861	Pa×s	344.57	Calculated Property
η	0.0005559	Pa×s	373.52	Calculated Property
η	0.0004131	Pa×s	402.46	Calculated Property
η	0.0003195	Pa×s	431.41	Calculated Property
η	0.0002552	Pa×s	460.36	Calculated Property
η	0.0002094	Pa×s	489.31	Calculated Property
η	0.0001756	Pa×s	518.25	Calculated Property

Similar Compounds

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

Sources

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

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