Chemical Properties of Phenol, 2,6-diallyl-

InChI

InChI=1S/C12H14O/c1-3-6-10-8-5-9-11(7-4-2)12(10)13/h3-5,8-9,13H,1-2,6-7H2

InChI Key

RMXNSQWYMVTLEU-UHFFFAOYSA-N

Formula

C12H14O

SMILES

C=CCc1cccc(CC=C)c1O

Molecular Weight¹

174.24

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• Δ_vapH° : Enthalpy of vaporization at standard conditions (kJ/mol).
• IE : Ionization energy (eV).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point 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 Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Log10 of Water solubility in mol/l 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	[202.61; 482.25]	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			-4.25280e+01
Coefficient B			1.12000e+00
Coefficient C			-8.95320e-04
Coefficient D			3.00100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	202.61	J/mol×K	273.00	Calculated Property
Cp,gas	254.93	J/mol×K	353.78	Calculated Property
Cp,gas	299.73	J/mol×K	434.56	Calculated Property
Cp,gas	337.95	J/mol×K	515.33	Calculated Property
Cp,gas	370.54	J/mol×K	596.11	Calculated Property
Cp,gas	398.44	J/mol×K	676.89	Calculated Property
Cp,gas	422.62	J/mol×K	757.67	Calculated Property
Cp,gas	444.01	J/mol×K	838.44	Calculated Property
Cp,gas	463.57	J/mol×K	919.22	Calculated Property
Cp,gas	482.25	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015633; 0.0000502]	Pa×s	[372.14; 560.66]	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			-1.66855e+01
Coefficient B			3.80498e+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.			372.14
Temperature range, max.			560.66
η	0.0015633	Pa×s	372.14	Calculated Property
η	0.0009066	Pa×s	393.09	Calculated Property
η	0.0005556	Pa×s	414.03	Calculated Property
η	0.0003569	Pa×s	434.98	Calculated Property
η	0.0002388	Pa×s	455.92	Calculated Property
η	0.0001655	Pa×s	476.87	Calculated Property
η	0.0001183	Pa×s	497.82	Calculated Property
η	0.0000869	Pa×s	518.76	Calculated Property
η	0.0000654	Pa×s	539.71	Calculated Property
η	0.0000502	Pa×s	560.66	Calculated Property

Similar Compounds

Find more compounds similar to Phenol, 2,6-diallyl-.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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