Chemical Properties of 3-Cyclohexen-1-ol, 3-methyl- (CAS 53783-91-8)

InChI

InChI=1S/C7H12O/c1-6-3-2-4-7(8)5-6/h3,7-8H,2,4-5H2,1H3

InChI Key

HKVFKEJBSWJQMU-UHFFFAOYSA-N

Formula

C7H12O

SMILES

CC1=CCCC(O)C1

Molecular Weight¹

112.17

CAS

53783-91-8

Other Names

• 3-Methyl-3-cyclohexen-1-ol

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• T_boil : Normal Boiling Point Temperature (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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	[124.44; 349.87]	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			-4.17100e+01
Coefficient B			7.09420e-01
Coefficient C			-3.88640e-04
Coefficient D			7.08000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	124.44	J/mol×K	273.00	Calculated Property
Cp,gas	163.76	J/mol×K	353.78	Calculated Property
Cp,gas	198.99	J/mol×K	434.56	Calculated Property
Cp,gas	230.36	J/mol×K	515.33	Calculated Property
Cp,gas	258.08	J/mol×K	596.11	Calculated Property
Cp,gas	282.38	J/mol×K	676.89	Calculated Property
Cp,gas	303.49	J/mol×K	757.67	Calculated Property
Cp,gas	321.62	J/mol×K	838.44	Calculated Property
Cp,gas	337.01	J/mol×K	919.22	Calculated Property
Cp,gas	349.87	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0292783; 0.0001995]	Pa×s	[250.13; 470.14]	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			-1.41910e+01
Coefficient B			2.66640e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			250.13
Temperature range, max.			470.14
η	0.0292783	Pa×s	250.13	Calculated Property
η	0.0113335	Pa×s	274.58	Calculated Property
η	0.0051236	Pa×s	299.02	Calculated Property
η	0.0026116	Pa×s	323.47	Calculated Property
η	0.0014634	Pa×s	347.91	Calculated Property
η	0.0008848	Pa×s	372.36	Calculated Property
η	0.0005692	Pa×s	396.81	Calculated Property
η	0.0003854	Pa×s	421.25	Calculated Property
η	0.0002723	Pa×s	445.70	Calculated Property
η	0.0001995	Pa×s	470.14	Calculated Property

Similar Compounds

Find more compounds similar to 3-Cyclohexen-1-ol, 3-methyl-.

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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