Chemical Properties of Adipic acid, 2,2-dichloroethyl hexadecyl ester

InChI

InChI=1S/C24H44Cl2O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-29-23(27)18-15-16-19-24(28)30-21-22(25)26/h22H,2-21H2,1H3

InChI Key

QYCHWEMELRPFJS-UHFFFAOYSA-N

Formula

C24H44Cl2O4

SMILES

CCCCCCCCCCCCCCCCOC(=O)CCCCC(=O)OCC(Cl)Cl

Molecular Weight¹

467.51

• 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	[573.78; 1290.81]	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			5.59900e+01
Coefficient B			2.19372e+00
Coefficient C			-1.13660e-03
Coefficient D			1.77700e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	573.78	J/mol×K	273.00	Calculated Property
Cp,gas	697.69	J/mol×K	353.78	Calculated Property
Cp,gas	809.23	J/mol×K	434.56	Calculated Property
Cp,gas	908.96	J/mol×K	515.33	Calculated Property
Cp,gas	997.44	J/mol×K	596.11	Calculated Property
Cp,gas	1075.24	J/mol×K	676.89	Calculated Property
Cp,gas	1142.91	J/mol×K	757.67	Calculated Property
Cp,gas	1201.02	J/mol×K	838.44	Calculated Property
Cp,gas	1250.14	J/mol×K	919.22	Calculated Property
Cp,gas	1290.81	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0005476; 0.0000274]	Pa×s	[489.74; 807.06]	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			-1.51266e+01
Coefficient B			3.73018e+03
Coefficient C			0.00000e+00
Coefficient D			0.00000e+00
Coefficient E			0.00000e+00
Temperature range, min.			489.74
Temperature range, max.			807.06
η	0.0005476	Pa×s	489.74	Calculated Property
η	0.0003284	Pa×s	525.00	Calculated Property
η	0.0002100	Pa×s	560.26	Calculated Property
η	0.0001416	Pa×s	595.51	Calculated Property
η	0.0000997	Pa×s	630.77	Calculated Property
η	0.0000729	Pa×s	666.03	Calculated Property
η	0.0000550	Pa×s	701.29	Calculated Property
η	0.0000427	Pa×s	736.54	Calculated Property
η	0.0000339	Pa×s	771.80	Calculated Property
η	0.0000274	Pa×s	807.06	Calculated Property

Similar Compounds

Find more compounds similar to Adipic acid, 2,2-dichloroethyl hexadecyl ester.

Sources

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

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