Chemical Properties of 2-(«alpha»-Methylbenzyl)-p-cresol (CAS 1817-67-0)

InChI

InChI=1S/C15H16O/c1-11-8-9-15(16)14(10-11)12(2)13-6-4-3-5-7-13/h3-10,12,16H,1-2H3

InChI Key

DJRYJQNZAYJVGF-UHFFFAOYSA-N

Formula

C15H16O

SMILES

Cc1ccc(O)c(C(C)c2ccccc2)c1

Molecular Weight¹

212.29

CAS

1817-67-0

• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, Standard Gibbs free energy of formation, Acentric Factor for this compound, but they fall outside the models' validated range, so they are not shown here. Open the prediction tool to compute them on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[228.30; 576.06]	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			-7.48600e+01
Coefficient B			1.37204e+00
Coefficient C			-1.04712e-03
Coefficient D			3.26000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	228.30	J/mol×K	273.00	Calculated Property
Cp,gas	293.92	J/mol×K	353.78	Calculated Property
Cp,gas	350.38	J/mol×K	434.56	Calculated Property
Cp,gas	398.73	J/mol×K	515.33	Calculated Property
Cp,gas	439.99	J/mol×K	596.11	Calculated Property
Cp,gas	475.20	J/mol×K	676.89	Calculated Property
Cp,gas	505.37	J/mol×K	757.67	Calculated Property
Cp,gas	531.56	J/mol×K	838.44	Calculated Property
Cp,gas	554.77	J/mol×K	919.22	Calculated Property
Cp,gas	576.06	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007566; 0.0000205]	Pa×s	[420.89; 651.48]	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			-1.73770e+01
Coefficient B			4.28902e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Comment			Liquid phase. Joback/Reid (1987), valid from Tf to 0.7·Tc.
Temperature range, min.			420.89
Temperature range, max.			651.48
η	0.0007566	Pa×s	420.89	Calculated Property
η	0.0004216	Pa×s	446.51	Calculated Property
η	0.0002503	Pa×s	472.13	Calculated Property
η	0.0001568	Pa×s	497.75	Calculated Property
η	0.0001029	Pa×s	523.37	Calculated Property
η	0.0000702	Pa×s	548.99	Calculated Property
η	0.0000495	Pa×s	574.61	Calculated Property
η	0.0000360	Pa×s	600.23	Calculated Property
η	0.0000269	Pa×s	625.86	Calculated Property
η	0.0000205	Pa×s	651.48	Calculated Property

Similar Compounds

Find more compounds similar to 2-(«alpha»-Methylbenzyl)-p-cresol.

Sources

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

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