Chemical Properties of 1-Formyl-4-hydroxymethylcyclohexane

InChI

InChI=1S/C8H14O2/c9-5-7-1-2-8(6-10)4-3-7/h5,7-8,10H,1-4,6H2

InChI Key

ZMVNSYYBXALPII-UHFFFAOYSA-N

Formula

C8H14O2

SMILES

O=CC1CCC(CO)CC1

Molecular Weight¹

142.20

• 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).
• 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).
• 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, 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	[156.75; 433.24]	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			-4.73590e+01
Coefficient B			8.67900e-01
Coefficient C			-4.60400e-04
Coefficient D			7.31000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	156.75	J/mol×K	273.00	Calculated Property
Cp,gas	205.30	J/mol×K	353.78	Calculated Property
Cp,gas	248.85	J/mol×K	434.56	Calculated Property
Cp,gas	287.64	J/mol×K	515.33	Calculated Property
Cp,gas	321.89	J/mol×K	596.11	Calculated Property
Cp,gas	351.84	J/mol×K	676.89	Calculated Property
Cp,gas	377.72	J/mol×K	757.67	Calculated Property
Cp,gas	399.76	J/mol×K	838.44	Calculated Property
Cp,gas	418.19	J/mol×K	919.22	Calculated Property
Cp,gas	433.24	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0197274; 0.0002375]	Pa×s	[285.88; 513.20]	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			-1.39038e+01
Coefficient B			2.85252e+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.			285.88
Temperature range, max.			513.20
η	0.0197274	Pa×s	285.88	Calculated Property
η	0.0087759	Pa×s	311.14	Calculated Property
η	0.0044090	Pa×s	336.39	Calculated Property
η	0.0024386	Pa×s	361.65	Calculated Property
η	0.0014572	Pa×s	386.91	Calculated Property
η	0.0009275	Pa×s	412.17	Calculated Property
η	0.0006220	Pa×s	437.42	Calculated Property
η	0.0004357	Pa×s	462.68	Calculated Property
η	0.0003166	Pa×s	487.94	Calculated Property
η	0.0002375	Pa×s	513.20	Calculated Property

Similar Compounds

Find more compounds similar to 1-Formyl-4-hydroxymethylcyclohexane.

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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