Chemical Properties of Dicyclohexylmethanol (CAS 4453-82-1)

InChI

InChI=1S/C13H24O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h11-14H,1-10H2

InChI Key

DEFUSPNGFCCTEU-UHFFFAOYSA-N

Formula

C13H24O

SMILES

OC(C1CCCCC1)C1CCCCC1

Molecular Weight¹

196.33

CAS

4453-82-1

Other Names

• Cyclohexanemethanol, «alpha»-cyclohexyl-
• Dicyclohexylcarbinol
• «alpha»-cyclohexylcyclohexanemethanol

• 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).
• 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_boilr : Boiling point at reduced pressure (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, 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.

Pressure Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[217.21; 679.37]	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			-1.36530e+02
Coefficient B			1.52290e+00
Coefficient C			-8.79000e-04
Coefficient D			1.72000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	217.21	J/mol×K	273.00	Calculated Property
Cp,gas	299.84	J/mol×K	353.78	Calculated Property
Cp,gas	373.38	J/mol×K	434.56	Calculated Property
Cp,gas	438.38	J/mol×K	515.33	Calculated Property
Cp,gas	495.37	J/mol×K	596.11	Calculated Property
Cp,gas	544.91	J/mol×K	676.89	Calculated Property
Cp,gas	587.53	J/mol×K	757.67	Calculated Property
Cp,gas	623.79	J/mol×K	838.44	Calculated Property
Cp,gas	654.22	J/mol×K	919.22	Calculated Property
Cp,gas	679.37	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0093280; 0.0000945]	Pa×s	[334.15; 589.80]	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			-1.52702e+01
Coefficient B			3.54047e+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.			334.15
Temperature range, max.			589.80
η	0.0093280	Pa×s	334.15	Calculated Property
η	0.0040670	Pa×s	362.56	Calculated Property
η	0.0020005	Pa×s	390.96	Calculated Property
η	0.0010833	Pa×s	419.37	Calculated Property
η	0.0006341	Pa×s	447.77	Calculated Property
η	0.0003956	Pa×s	476.18	Calculated Property
η	0.0002603	Pa×s	504.58	Calculated Property
η	0.0001791	Pa×s	532.99	Calculated Property
η	0.0001280	Pa×s	561.39	Calculated Property
η	0.0000945	Pa×s	589.80	Calculated Property

Similar Compounds

Find more compounds similar to Dicyclohexylmethanol.

Sources

• Jean-Claude Bradley Open Melting Point Dataset (2014, CC0) ChEDL chemicals 1.5.2, from Bradley, J.-C.; Williams, A.; Lang, A. Jean-Claude Bradley Open Melting Point Dataset. Figshare, 2014 (CC0).
• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
Calculated This icon marks a calculated value or equation: a prediction, not a measurement.
Compiled This icon marks a compiled value or equation: taken from a data compilation such as ChemSep, not from an original measurement report.
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