Chemical Properties of 1-(4-TOLYL)-1-CYCLOHEXENE

InChI

InChI=1S/C13H16/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h5,7-10H,2-4,6H2,1H3

InChI Key

YAOVYZVTIFLTSH-UHFFFAOYSA-N

Formula

C13H16

SMILES

Cc1ccc(C2=CCCCC2)cc1

Molecular Weight¹

172.27

Other Names

• 1-(1-cyclohexen-1-yl)-4-methylbenzene

• 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).
• log₁₀WS : Log10 of Water solubility in mol/l.
• 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_c : Critical Temperature (K).
• T_fus : Normal melting (fusion) point (K).
• V_c : Critical Volume (m³/kmol).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Standard Gibbs free energy of formation, Acentric Factor 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	[182.25; 512.52]	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			-7.80000e+01
Coefficient B			1.13352e+00
Coefficient C			-7.04200e-04
Coefficient D			1.61200e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	182.25	J/mol×K	273.00	Calculated Property
Cp,gas	242.02	J/mol×K	353.78	Calculated Property
Cp,gas	294.83	J/mol×K	434.56	Calculated Property
Cp,gas	341.19	J/mol×K	515.33	Calculated Property
Cp,gas	381.61	J/mol×K	596.11	Calculated Property
Cp,gas	416.61	J/mol×K	676.89	Calculated Property
Cp,gas	446.69	J/mol×K	757.67	Calculated Property
Cp,gas	472.36	J/mol×K	838.44	Calculated Property
Cp,gas	494.14	J/mol×K	919.22	Calculated Property
Cp,gas	512.52	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0026461; 0.0001805]	Pa×s	[300.11; 558.56]	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			-1.17379e+01
Coefficient B			1.74162e+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.			300.11
Temperature range, max.			558.56
η	0.0026461	Pa×s	300.11	Calculated Property
η	0.0015941	Pa×s	328.83	Calculated Property
η	0.0010418	Pa×s	357.54	Calculated Property
η	0.0007253	Pa×s	386.26	Calculated Property
η	0.0005309	Pa×s	414.97	Calculated Property
η	0.0004046	Pa×s	443.69	Calculated Property
η	0.0003187	Pa×s	472.41	Calculated Property
η	0.0002580	Pa×s	501.12	Calculated Property
η	0.0002137	Pa×s	529.84	Calculated Property
η	0.0001805	Pa×s	558.56	Calculated Property

Similar Compounds

Find more compounds similar to 1-(4-TOLYL)-1-CYCLOHEXENE.

Sources

• Cheméo Relay (1.0)
• Crippen Method
• Crippen Method
• Joback Method
• McGowan Method
• NIST Webbook

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