Chemical Properties of Cyclohexanol, 2-chloro-, trans-

InChI

InChI=1S/C6H11ClO/c7-5-3-1-2-4-6(5)8/h5-6,8H,1-4H2/t5-,6-/m0/s1

InChI Key

NYEWDMNOXFGGDX-PHDIDXHHSA-N

Formula

C6H11ClO

SMILES

O[C@H]1CCCC[C@@H]1Cl

Molecular Weight¹

134.61

Other Names

• trans-2-Chlorocyclohexanol
• 2-Chlorocyclohexanol, (E)-

• 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).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_p : Polar retention indices.
• 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, 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	[122.82; 347.55]	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			-4.40500e+01
Coefficient B			7.10200e-01
Coefficient C			-3.79000e-04
Coefficient D			6.04000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	122.82	J/mol×K	273.00	Calculated Property
Cp,gas	162.44	J/mol×K	353.78	Calculated Property
Cp,gas	197.96	J/mol×K	434.56	Calculated Property
Cp,gas	229.56	J/mol×K	515.33	Calculated Property
Cp,gas	257.43	J/mol×K	596.11	Calculated Property
Cp,gas	281.76	J/mol×K	676.89	Calculated Property
Cp,gas	302.75	J/mol×K	757.67	Calculated Property
Cp,gas	320.58	J/mol×K	838.44	Calculated Property
Cp,gas	335.45	J/mol×K	919.22	Calculated Property
Cp,gas	347.55	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0062363; 0.0002420]	Pa×s	[300.90; 477.56]	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			-1.38606e+01
Coefficient B			2.64289e+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.			300.90
Temperature range, max.			477.56
η	0.0062363	Pa×s	300.90	Calculated Property
η	0.0036419	Pa×s	320.53	Calculated Property
η	0.0022630	Pa×s	340.16	Calculated Property
η	0.0014811	Pa×s	359.79	Calculated Property
η	0.0010129	Pa×s	379.42	Calculated Property
η	0.0007190	Pa×s	399.04	Calculated Property
η	0.0005271	Pa×s	418.67	Calculated Property
η	0.0003973	Pa×s	438.30	Calculated Property
η	0.0003068	Pa×s	457.93	Calculated Property
η	0.0002420	Pa×s	477.56	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexanol, 2-chloro-, trans-.

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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Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
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