Chemical Properties of Bis(2-ethylhexyl) 4-cyclohexene-1,2-dicarboxylate (CAS 2915-49-3)

InChI

InChI=1S/C24H42O4/c1-5-9-13-19(7-3)17-27-23(25)21-15-11-12-16-22(21)24(26)28-18-20(8-4)14-10-6-2/h11-12,19-22H,5-10,13-18H2,1-4H3

InChI Key

SVVBLKNHJWTATO-UHFFFAOYSA-N

Formula

C24H42O4

SMILES

CCCCC(CC)COC(=O)C1CC=CCC1C(=O)OCC(CC)CCCC

Molecular Weight¹

394.59

CAS

2915-49-3

Other Names

• 4-Cyclohexene-1,2-dicarboxylic acid, di(2-ethylhexyl) ester

• 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).
• 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_fus : Normal melting (fusion) point (K).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Temperature, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy 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	[504.33; 1235.24]	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			-2.33600e+01
Coefficient B			2.22568e+00
Coefficient C			-1.11188e-03
Coefficient D			1.44800e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	504.33	J/mol×K	273.00	Calculated Property
Cp,gas	631.29	J/mol×K	353.78	Calculated Property
Cp,gas	745.74	J/mol×K	434.56	Calculated Property
Cp,gas	848.14	J/mol×K	515.33	Calculated Property
Cp,gas	938.96	J/mol×K	596.11	Calculated Property
Cp,gas	1018.65	J/mol×K	676.89	Calculated Property
Cp,gas	1087.66	J/mol×K	757.67	Calculated Property
Cp,gas	1146.46	J/mol×K	838.44	Calculated Property
Cp,gas	1195.50	J/mol×K	919.22	Calculated Property
Cp,gas	1235.24	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0015178; 0.0000503]	Pa×s	[418.80; 754.78]	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			-1.41461e+01
Coefficient B			3.20618e+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.			418.80
Temperature range, max.			754.78
η	0.0015178	Pa×s	418.80	Calculated Property
η	0.0008111	Pa×s	456.13	Calculated Property
η	0.0004766	Pa×s	493.46	Calculated Property
η	0.0003018	Pa×s	530.79	Calculated Property
η	0.0002029	Pa×s	568.13	Calculated Property
η	0.0001433	Pa×s	605.46	Calculated Property
η	0.0001053	Pa×s	642.79	Calculated Property
η	0.0000801	Pa×s	680.12	Calculated Property
η	0.0000627	Pa×s	717.45	Calculated Property
η	0.0000503	Pa×s	754.78	Calculated Property

Similar Compounds

Find more compounds similar to Bis(2-ethylhexyl) 4-cyclohexene-1,2-dicarboxylate.

Sources

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

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