Chemical Properties of Benzene, (cyclohexylmethyl)- (CAS 4410-75-7)

InChI

InChI=1S/C13H18/c1-3-7-12(8-4-1)11-13-9-5-2-6-10-13/h1,3-4,7-8,13H,2,5-6,9-11H2

InChI Key

AHHIZGRCBJEBIX-UHFFFAOYSA-N

Formula

C13H18

SMILES

c1ccc(CC2CCCCC2)cc1

Molecular Weight¹

174.28

CAS

4410-75-7

Other Names

• Benzylcyclohexane
• Cyclohexane, (phenylmethyl)-
• Methane, cyclohexylphenyl-
• cyclohexylphenylmethane
• «alpha»-Cyclohexyltoluene

• 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).
• 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	[185.89; 556.56]	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			-1.08439e+02
Coefficient B			1.28200e+00
Coefficient C			-7.95600e-04
Coefficient D			1.78600e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	185.89	J/mol×K	273.00	Calculated Property
Cp,gas	253.44	J/mol×K	353.78	Calculated Property
Cp,gas	313.08	J/mol×K	434.56	Calculated Property
Cp,gas	365.37	J/mol×K	515.33	Calculated Property
Cp,gas	410.89	J/mol×K	596.11	Calculated Property
Cp,gas	450.20	J/mol×K	676.89	Calculated Property
Cp,gas	483.85	J/mol×K	757.67	Calculated Property
Cp,gas	512.42	J/mol×K	838.44	Calculated Property
Cp,gas	536.47	J/mol×K	919.22	Calculated Property
Cp,gas	556.56	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0049346; 0.0002085]	Pa×s	[270.07; 545.59]	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			-1.15773e+01
Coefficient B			1.69221e+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.			270.07
Temperature range, max.			545.59
η	0.0049346	Pa×s	270.07	Calculated Property
η	0.0026074	Pa×s	300.68	Calculated Property
η	0.0015501	Pa×s	331.30	Calculated Property
η	0.0010062	Pa×s	361.91	Calculated Property
η	0.0006988	Pa×s	392.52	Calculated Property
η	0.0005115	Pa×s	423.14	Calculated Property
η	0.0003906	Pa×s	453.75	Calculated Property
η	0.0003085	Pa×s	484.36	Calculated Property
η	0.0002507	Pa×s	514.98	Calculated Property
η	0.0002085	Pa×s	545.59	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, (cyclohexylmethyl)-.

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

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.
These property values are available through the Cheméo API. A free account gives you an access key.