Chemical Properties of Cyclohexane, 1r,2c,4t-triethyl

InChI

InChI=1S/C12H24/c1-4-10-7-8-11(5-2)12(6-3)9-10/h10-12H,4-9H2,1-3H3/t10-,11-,12+/m1/s1

InChI Key

UAVQBNTWBGIJRO-UTUOFQBUSA-N

Formula

C12H24

SMILES

CCC1CCC(CC)C(CC)C1

Molecular Weight¹

168.32

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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).
• I_np : Non-polar retention indices.
• 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 Log10 of Water solubility in mol/l for this compound, but it falls outside the models' validated range, so it is not shown here. Open the prediction tool to compute it on demand.

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[226.46; 636.81]	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			-6.17470e+01
Coefficient B			1.21296e+00
Coefficient C			-5.99200e-04
Coefficient D			8.48000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	226.46	J/mol×K	273.00	Calculated Property
Cp,gas	296.13	J/mol×K	353.78	Calculated Property
Cp,gas	359.16	J/mol×K	434.56	Calculated Property
Cp,gas	415.81	J/mol×K	515.33	Calculated Property
Cp,gas	466.35	J/mol×K	596.11	Calculated Property
Cp,gas	511.05	J/mol×K	676.89	Calculated Property
Cp,gas	550.18	J/mol×K	757.67	Calculated Property
Cp,gas	584.00	J/mol×K	838.44	Calculated Property
Cp,gas	612.79	J/mol×K	919.22	Calculated Property
Cp,gas	636.81	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0033609; 0.0002714]	Pa×s	[223.90; 473.29]	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			-1.04711e+01
Coefficient B			1.06925e+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.			223.90
Temperature range, max.			473.29
η	0.0033609	Pa×s	223.90	Calculated Property
η	0.0019863	Pa×s	251.61	Calculated Property
η	0.0013030	Pa×s	279.32	Calculated Property
η	0.0009224	Pa×s	307.03	Calculated Property
η	0.0006914	Pa×s	334.74	Calculated Property
η	0.0005416	Pa×s	362.45	Calculated Property
η	0.0004392	Pa×s	390.16	Calculated Property
η	0.0003662	Pa×s	417.87	Calculated Property
η	0.0003123	Pa×s	445.58	Calculated Property
η	0.0002714	Pa×s	473.29	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, 1r,2c,4t-triethyl.

Sources

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

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