Chemical Properties of Adipic acid, cis-non-3-enyl decyl ester

InChI

InChI=1S/C25H46O4/c1-3-5-7-9-11-13-15-19-23-29-25(27)21-17-16-20-24(26)28-22-18-14-12-10-8-6-4-2/h12,14H,3-11,13,15-23H2,1-2H3/b14-12-

InChI Key

NKBYHSBIOOFMNZ-OWBHPGMISA-N

Formula

C25H46O4

SMILES

CCCCCC=CCCOC(=O)CCCCC(=O)OCCCCCCCCCC

Molecular Weight¹

410.63

• 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).
• 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 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	[554.50; 1294.74]	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			1.67990e+01
Coefficient B			2.28924e+00
Coefficient C			-1.23080e-03
Coefficient D			2.19500e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	554.50	J/mol×K	273.00	Calculated Property
Cp,gas	682.35	J/mol×K	353.78	Calculated Property
Cp,gas	797.19	J/mol×K	434.56	Calculated Property
Cp,gas	899.70	J/mol×K	515.33	Calculated Property
Cp,gas	990.57	J/mol×K	596.11	Calculated Property
Cp,gas	1070.51	J/mol×K	676.89	Calculated Property
Cp,gas	1140.20	J/mol×K	757.67	Calculated Property
Cp,gas	1200.34	J/mol×K	838.44	Calculated Property
Cp,gas	1251.62	J/mol×K	919.22	Calculated Property
Cp,gas	1294.74	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007192; 0.0000320]	Pa×s	[451.09; 765.29]	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			-1.48193e+01
Coefficient B			3.42012e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			451.09
Temperature range, max.			765.29
η	0.0007192	Pa×s	451.09	Calculated Property
η	0.0004172	Pa×s	486.00	Calculated Property
η	0.0002603	Pa×s	520.91	Calculated Property
η	0.0001723	Pa×s	555.82	Calculated Property
η	0.0001198	Pa×s	590.73	Calculated Property
η	0.0000867	Pa×s	625.64	Calculated Property
η	0.0000650	Pa×s	660.55	Calculated Property
η	0.0000501	Pa×s	695.46	Calculated Property
η	0.0000396	Pa×s	730.37	Calculated Property
η	0.0000320	Pa×s	765.29	Calculated Property

Similar Compounds

Find more compounds similar to Adipic acid, cis-non-3-enyl decyl ester.

Sources

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

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