Chemical Properties of 1,3-Diisopropylcyclohexane

InChI

InChI=1S/C12H24/c1-9(2)11-6-5-7-12(8-11)10(3)4/h9-12H,5-8H2,1-4H3

InChI Key

WDTCMYUFBNCSKK-UHFFFAOYSA-N

Formula

C12H24

SMILES

CC(C)C1CCCC(C(C)C)C1

Molecular Weight¹

168.32

• 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_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.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[223.56; 631.23]	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			-7.10500e+01
Coefficient B			1.25128e+00
Coefficient C			-6.61000e-04
Coefficient D			1.12000e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	223.56	J/mol×K	273.00	Calculated Property
Cp,gas	293.85	J/mol×K	353.78	Calculated Property
Cp,gas	357.07	J/mol×K	434.56	Calculated Property
Cp,gas	413.56	J/mol×K	515.33	Calculated Property
Cp,gas	463.69	J/mol×K	596.11	Calculated Property
Cp,gas	507.81	J/mol×K	676.89	Calculated Property
Cp,gas	546.26	J/mol×K	757.67	Calculated Property
Cp,gas	579.42	J/mol×K	838.44	Calculated Property
Cp,gas	607.62	J/mol×K	919.22	Calculated Property
Cp,gas	631.23	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0144098; 0.0002294]	Pa×s	[198.14; 482.21]	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			-1.12681e+01
Coefficient B			1.39258e+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.			198.14
Temperature range, max.			482.21
η	0.0144098	Pa×s	198.14	Calculated Property
η	0.0054857	Pa×s	229.70	Calculated Property
η	0.0026372	Pa×s	261.27	Calculated Property
η	0.0014847	Pa×s	292.83	Calculated Property
η	0.0009347	Pa×s	324.40	Calculated Property
η	0.0006388	Pa×s	355.96	Calculated Property
η	0.0004645	Pa×s	387.52	Calculated Property
η	0.0003544	Pa×s	419.09	Calculated Property
η	0.0002808	Pa×s	450.65	Calculated Property
η	0.0002294	Pa×s	482.21	Calculated Property

Similar Compounds

Find more compounds similar to 1,3-Diisopropylcyclohexane.

Sources

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

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