Chemical Properties of Pentanedioic acid, bis-(isodecyl) ester (CAS 3634-94-4)

InChI

InChI=1S/C25H48O4/c1-3-5-7-9-11-13-15-17-22-28-24(26)20-19-21-25(27)29-23-18-16-14-12-10-8-6-4-2/h3-23H2,1-2H3

InChI Key

FFPZYKQFAKXVSW-UHFFFAOYSA-N

Formula

C25H48O4

SMILES

CCCCCCCCCCOC(=O)CCCC(=O)OCCCCCCCCCC

Molecular Weight¹

412.65

CAS

3634-94-4

Other Names

• didecyl glutarate

• ω : Acentric Factor.
• 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).
• IE : Ionization energy (eV).
• 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_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 Standard Gibbs free energy of formation 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	[568.50; 1325.32]	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			3.09810e+01
Coefficient B			2.26924e+00
Coefficient C			-1.14700e-03
Coefficient D			1.72100e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	568.50	J/mol×K	273.00	Calculated Property
Cp,gas	697.85	J/mol×K	353.78	Calculated Property
Cp,gas	814.62	J/mol×K	434.56	Calculated Property
Cp,gas	919.34	J/mol×K	515.33	Calculated Property
Cp,gas	1012.57	J/mol×K	596.11	Calculated Property
Cp,gas	1094.85	J/mol×K	676.89	Calculated Property
Cp,gas	1166.72	J/mol×K	757.67	Calculated Property
Cp,gas	1228.72	J/mol×K	838.44	Calculated Property
Cp,gas	1281.41	J/mol×K	919.22	Calculated Property
Cp,gas	1325.32	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007626; 0.0000367]	Pa×s	[456.17; 762.45]	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			-1.47284e+01
Coefficient B			3.44388e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			456.17
Temperature range, max.			762.45
η	0.0007626	Pa×s	456.17	Calculated Property
η	0.0004515	Pa×s	490.20	Calculated Property
η	0.0002861	Pa×s	524.23	Calculated Property
η	0.0001917	Pa×s	558.26	Calculated Property
η	0.0001345	Pa×s	592.30	Calculated Property
η	0.0000981	Pa×s	626.33	Calculated Property
η	0.0000739	Pa×s	660.36	Calculated Property
η	0.0000572	Pa×s	694.39	Calculated Property
η	0.0000454	Pa×s	728.42	Calculated Property
η	0.0000367	Pa×s	762.45	Calculated Property

Similar Compounds

Find more compounds similar to Pentanedioic acid, bis-(isodecyl) ester.

Sources

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

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