Chemical Properties of 2-(.alpha.,.alpha.-dimethylbenzyl) phenol

InChI

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

InChI Key

CJWNFAKWHDOUKL-UHFFFAOYSA-N

Formula

C15H16O

SMILES

CC(C)(c1ccccc1)c1ccccc1O

Molecular Weight¹

212.29

Other Names

• o-(«alpha»,«alpha»-Dimethylbenzyl)phenol
• 2-(«alpha»,«alpha»-Dimethylbenzyl)phenol
• Dimethylphenol-2-ylphenylmethane

• 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).
• 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 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	[224.60; 580.03]	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			-1.11950e+02
Coefficient B			1.55144e+00
Coefficient C			-1.28276e-03
Coefficient D			4.23300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	224.60	J/mol×K	273.00	Calculated Property
Cp,gas	295.11	J/mol×K	353.78	Calculated Property
Cp,gas	354.74	J/mol×K	434.56	Calculated Property
Cp,gas	404.83	J/mol×K	515.33	Calculated Property
Cp,gas	446.72	J/mol×K	596.11	Calculated Property
Cp,gas	481.75	J/mol×K	676.89	Calculated Property
Cp,gas	511.26	J/mol×K	757.67	Calculated Property
Cp,gas	536.58	J/mol×K	838.44	Calculated Property
Cp,gas	559.06	J/mol×K	919.22	Calculated Property
Cp,gas	580.03	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007455; 0.0000183]	Pa×s	[425.79; 652.47]	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			-1.78710e+01
Coefficient B			4.54300e+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.			425.79
Temperature range, max.			652.47
η	0.0007455	Pa×s	425.79	Calculated Property
η	0.0004108	Pa×s	450.98	Calculated Property
η	0.0002411	Pa×s	476.16	Calculated Property
η	0.0001493	Pa×s	501.35	Calculated Property
η	0.0000968	Pa×s	526.54	Calculated Property
η	0.0000653	Pa×s	551.72	Calculated Property
η	0.0000456	Pa×s	576.91	Calculated Property
η	0.0000328	Pa×s	602.09	Calculated Property
η	0.0000242	Pa×s	627.28	Calculated Property
η	0.0000183	Pa×s	652.47	Calculated Property

Similar Compounds

Find more compounds similar to 2-(.alpha.,.alpha.-dimethylbenzyl) phenol.

Sources

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

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