Chemical Properties of Sebacic acid, 10-chlorodecyl propyl ester

InChI

InChI=1S/C23H43ClO4/c1-2-20-27-22(25)17-13-9-5-6-10-14-18-23(26)28-21-16-12-8-4-3-7-11-15-19-24/h2-21H2,1H3

InChI Key

UIBBTBGARAPYEG-UHFFFAOYSA-N

Formula

C23H43ClO4

SMILES

CCCOC(=O)CCCCCCCCC(=O)OCCCCCCCCCCCl

Molecular Weight¹

419.04

• 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	[539.48; 1230.41]	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			4.56900e+01
Coefficient B			2.08602e+00
Coefficient C			-1.05860e-03
Coefficient D			1.57300e-07
Coefficient E			0.00000e+00
Temperature range, min.			273.00
Temperature range, max.			1000.00
Cp,gas	539.48	J/mol×K	273.00	Calculated Property
Cp,gas	658.15	J/mol×K	353.78	Calculated Property
Cp,gas	765.19	J/mol×K	434.56	Calculated Property
Cp,gas	861.08	J/mol×K	515.33	Calculated Property
Cp,gas	946.34	J/mol×K	596.11	Calculated Property
Cp,gas	1021.45	J/mol×K	676.89	Calculated Property
Cp,gas	1086.92	J/mol×K	757.67	Calculated Property
Cp,gas	1143.23	J/mol×K	838.44	Calculated Property
Cp,gas	1190.90	J/mol×K	919.22	Calculated Property
Cp,gas	1230.41	J/mol×K	1000.00	Calculated Property

Property	Value	Unit	Temperature (K)	Source
η	[0.0007345; 0.0000425]	Pa×s	[463.55; 754.15]	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			-1.46090e+01
Coefficient B			3.42688e+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.			463.55
Temperature range, max.			754.15
η	0.0007345	Pa×s	463.55	Calculated Property
η	0.0004538	Pa×s	495.84	Calculated Property
η	0.0002974	Pa×s	528.13	Calculated Property
η	0.0002047	Pa×s	560.42	Calculated Property
η	0.0001467	Pa×s	592.71	Calculated Property
η	0.0001088	Pa×s	625.00	Calculated Property
η	0.0000831	Pa×s	657.29	Calculated Property
η	0.0000651	Pa×s	689.58	Calculated Property
η	0.0000521	Pa×s	721.86	Calculated Property
η	0.0000425	Pa×s	754.15	Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, 10-chlorodecyl propyl ester.

Sources

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

Note: Cheméo is only indexing the data, follow the source links to retrieve the latest data. The source is also providing more information like the publication year, authors and more. Take the time to validate and double check the source of the data.
These property values are available through the Cheméo API. A free account gives you an access key.