Chemical Properties of 1,2-Cyclohexanedicarboxylic acid, ethyl pentyl ester

InChI

InChI=1S/C15H26O4/c1-3-5-8-11-19-15(17)13-10-7-6-9-12(13)14(16)18-4-2/h12-13H,3-11H2,1-2H3

InChI Key

PCPOYRXAOUSZIA-UHFFFAOYSA-N

Formula

C15H26O4

SMILES

CCCCCOC(=O)C1CCCCC1C(=O)OCC

Molecular Weight¹

270.37

• 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).
• 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).
• 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).
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Cheméo can also estimate Critical Volume, 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	[320.51; 801.15]	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			-1.95950e+01
Coefficient B			1.41484e+00
Coefficient C			-6.28600e-04
Coefficient D			3.45000e-08
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	320.51	J/mol×K	273.00	Calculated Property
Cp,gas	403.80	J/mol×K	353.78	Calculated Property
Cp,gas	479.36	J/mol×K	434.56	Calculated Property
Cp,gas	547.30	J/mol×K	515.33	Calculated Property
Cp,gas	607.74	J/mol×K	596.11	Calculated Property
Cp,gas	660.78	J/mol×K	676.89	Calculated Property
Cp,gas	706.53	J/mol×K	757.67	Calculated Property
Cp,gas	745.11	J/mol×K	838.44	Calculated Property
Cp,gas	776.61	J/mol×K	919.22	Calculated Property
Cp,gas	801.15	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0030458; 0.0001601]	Pa×s	[346.61; 607.22]	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			-1.26572e+01
Coefficient B			2.37886e+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.			346.61
Temperature range, max.			607.22
η	0.0030458	Pa×s	346.61	Calculated Property
η	0.0017943	Pa×s	375.57	Calculated Property
η	0.0011402	Pa×s	404.52	Calculated Property
η	0.0007698	Pa×s	433.48	Calculated Property
η	0.0005459	Pa×s	462.44	Calculated Property
η	0.0004032	Pa×s	491.39	Calculated Property
η	0.0003080	Pa×s	520.35	Calculated Property
η	0.0002420	Pa×s	549.30	Calculated Property
η	0.0001948	Pa×s	578.26	Calculated Property
η	0.0001601	Pa×s	607.22	Calculated Property

Similar Compounds

Find more compounds similar to 1,2-Cyclohexanedicarboxylic acid, ethyl pentyl ester.

Sources

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

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