Chemical Properties of Cyclohexane, 1,1',1''-(1-ethanyl-2-ylidene)tris- (CAS 55682-86-5)

InChI

InChI=1S/C20H36/c1-4-10-17(11-5-1)16-20(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h17-20H,1-16H2

InChI Key

ZRLRQTYAHVRATD-UHFFFAOYSA-N

Formula

C20H36

SMILES

C1CCC(CC(C2CCCCC2)C2CCCCC2)CC1

Molecular Weight¹

276.50

CAS

55682-86-5

Other Names

• 1,1,2-tricyclohexylethane

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• 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, Enthalpy of formation at standard conditions, 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	[315.09; 1006.91]	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			-2.13789e+02
Coefficient B			2.27600e+00
Coefficient C			-1.31040e-03
Coefficient D			2.55100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	315.09	J/mol×K	273.00	Calculated Property
Cp,gas	438.70	J/mol×K	353.78	Calculated Property
Cp,gas	548.74	J/mol×K	434.56	Calculated Property
Cp,gas	646.02	J/mol×K	515.33	Calculated Property
Cp,gas	731.35	J/mol×K	596.11	Calculated Property
Cp,gas	805.53	J/mol×K	676.89	Calculated Property
Cp,gas	869.37	J/mol×K	757.67	Calculated Property
Cp,gas	923.67	J/mol×K	838.44	Calculated Property
Cp,gas	969.25	J/mol×K	919.22	Calculated Property
Cp,gas	1006.91	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0088398; 0.0001345]	Pa×s	[322.30; 668.70]	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			-1.28088e+01
Coefficient B			2.60427e+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.			322.30
Temperature range, max.			668.70
η	0.0088398	Pa×s	322.30	Calculated Property
η	0.0037332	Pa×s	360.79	Calculated Property
η	0.0018616	Pa×s	399.28	Calculated Property
η	0.0010491	Pa×s	437.77	Calculated Property
η	0.0006487	Pa×s	476.26	Calculated Property
η	0.0004310	Pa×s	514.75	Calculated Property
η	0.0003031	Pa×s	553.23	Calculated Property
η	0.0002232	Pa×s	591.72	Calculated Property
η	0.0001706	Pa×s	630.21	Calculated Property
η	0.0001345	Pa×s	668.70	Calculated Property

Similar Compounds

Find more compounds similar to Cyclohexane, 1,1',1''-(1-ethanyl-2-ylidene)tris-.

Sources

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

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