Chemical Properties of Sebacic acid, 10-chlorodecyl ethyl ester

InChI

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

InChI Key

IOEWKIOXNCTQAY-UHFFFAOYSA-N

Formula

C22H41ClO4

SMILES

CCOC(=O)CCCCCCCCC(=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_fG° : Standard Gibbs free energy of formation (kJ/mol).
• 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

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
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 Sebacic acid, 10-chlorodecyl ethyl ester.

Sources

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

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