Chemical Properties of Benzene, [6-cyclopentyl-3-(3-cyclopentylpropyl)hexyl]-

InChI

InChI=1S/C25H40/c1-2-10-24(11-3-1)20-21-25(18-8-16-22-12-4-5-13-22)19-9-17-23-14-6-7-15-23/h1-3,10-11,22-23,25H,4-9,12-21H2

InChI Key

CFGYPQLTAHANIB-UHFFFAOYSA-N

Formula

C25H40

SMILES

c1ccc(CCC(CCCC2CCCC2)CCCC2CCCC2)cc1

Molecular Weight¹

340.59

Other Names

• 1,7-Dicyclopentyl-4-(2-phenethyl)heptane

• 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).
• Δ_vapH : Enthalpy of vaporization at a given temperature (kJ/mol).
• 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, Enthalpy of formation at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, 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.

Temperature Dependent Properties

Correlations

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[411.80; 1157.71]	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			-1.76392e+02
Coefficient B			2.56920e+00
Coefficient C			-1.62540e-03
Coefficient D			3.90300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	411.80	J/mol×K	273.00	Calculated Property
Cp,gas	546.38	J/mol×K	353.78	Calculated Property
Cp,gas	665.16	J/mol×K	434.56	Calculated Property
Cp,gas	769.36	J/mol×K	515.33	Calculated Property
Cp,gas	860.23	J/mol×K	596.11	Calculated Property
Cp,gas	938.99	J/mol×K	676.89	Calculated Property
Cp,gas	1006.89	J/mol×K	757.67	Calculated Property
Cp,gas	1065.15	J/mol×K	838.44	Calculated Property
Cp,gas	1115.01	J/mol×K	919.22	Calculated Property
Cp,gas	1157.71	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0026391; 0.0001569]	Pa×s	[404.73; 731.51]	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			-1.22563e+01
Coefficient B			2.55748e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			404.73
Temperature range, max.			731.51
η	0.0026391	Pa×s	404.73	Calculated Property
η	0.0015687	Pa×s	441.04	Calculated Property
η	0.0010092	Pa×s	477.35	Calculated Property
η	0.0006910	Pa×s	513.66	Calculated Property
η	0.0004974	Pa×s	549.96	Calculated Property
η	0.0003730	Pa×s	586.27	Calculated Property
η	0.0002892	Pa×s	622.58	Calculated Property
η	0.0002306	Pa×s	658.89	Calculated Property
η	0.0001883	Pa×s	695.20	Calculated Property
η	0.0001569	Pa×s	731.51	Calculated Property

Similar Compounds

Find more compounds similar to Benzene, [6-cyclopentyl-3-(3-cyclopentylpropyl)hexyl]-.

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

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