Chemical Properties of Adipic acid, 10-chlorodecyl hexyl ester

InChI

InChI=1S/C22H41ClO4/c1-2-3-4-14-19-26-21(24)16-11-12-17-22(25)27-20-15-10-8-6-5-7-9-13-18-23/h2-20H2,1H3

InChI Key

QJHMRCBMXRIYCD-UHFFFAOYSA-N

Formula

C22H41ClO4

SMILES

CCCCCCOC(=O)CCCCC(=O)OCCCCCCCCCCCl

Molecular Weight¹

405.01

• 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).
• 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).
• 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	[518.26; 1178.82]	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			4.65990e+01
Coefficient B			1.99102e+00
Coefficient C			-1.00420e-03
Coefficient D			1.45400e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	518.26	J/mol×K	273.00	Calculated Property
Cp,gas	631.73	J/mol×K	353.78	Calculated Property
Cp,gas	734.11	J/mol×K	434.56	Calculated Property
Cp,gas	825.85	J/mol×K	515.33	Calculated Property
Cp,gas	907.43	J/mol×K	596.11	Calculated Property
Cp,gas	979.29	J/mol×K	676.89	Calculated Property
Cp,gas	1041.90	J/mol×K	757.67	Calculated Property
Cp,gas	1095.72	J/mol×K	838.44	Calculated Property
Cp,gas	1141.20	J/mol×K	919.22	Calculated Property
Cp,gas	1178.82	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0008457; 0.0000499]	Pa×s	[452.28; 734.31]	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			-1.44441e+01
Coefficient B			3.33272e+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.			452.28
Temperature range, max.			734.31
η	0.0008457	Pa×s	452.28	Calculated Property
η	0.0005246	Pa×s	483.62	Calculated Property
η	0.0003449	Pa×s	514.95	Calculated Property
η	0.0002380	Pa×s	546.29	Calculated Property
η	0.0001709	Pa×s	577.63	Calculated Property
η	0.0001270	Pa×s	608.96	Calculated Property
η	0.0000972	Pa×s	640.30	Calculated Property
η	0.0000762	Pa×s	671.63	Calculated Property
η	0.0000611	Pa×s	702.97	Calculated Property
η	0.0000499	Pa×s	734.31	Calculated Property

Similar Compounds

Find more compounds similar to Adipic acid, 10-chlorodecyl hexyl ester.

Sources

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

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