Chemical Properties of Sebacic acid, di(2,3-dichlorobenzyl) ester

InChI

InChI=1S/C24H26Cl4O4/c25-19-11-7-9-17(23(19)27)15-31-21(29)13-5-3-1-2-4-6-14-22(30)32-16-18-10-8-12-20(26)24(18)28/h7-12H,1-6,13-16H2

InChI Key

ZVJHCOYZRNVBCX-UHFFFAOYSA-N

Formula

C24H26Cl4O4

SMILES

O=C(CCCCCCCCC(=O)OCc1cccc(Cl)c1Cl)OCc1cccc(Cl)c1Cl

Molecular Weight¹

520.27

• C_p,gas : Ideal gas heat capacity (J/mol×K).
• η : Dynamic viscosity (Pa×s).
• Δ_fusH° : Enthalpy of fusion at standard conditions (kJ/mol).
• logP_oct/wat : Octanol/Water partition coefficient.
• McVol : McGowan's characteristic volume (ml/mol).
• I_np : Non-polar retention indices.
• ¹: Molecular weight from the IUPAC atomic weights tables.

Physical Properties

Property	Value	Unit	Source
ΔfusH°	69.97	kJ/mol	Joback Calculated Property
logPoct/wat	8.208		Crippen Calculated Property
McVol	365.340	ml/mol	McGowan Calculated Property
Inp	[3663.00; 3663.00]
Inp	3663.00		NIST
Inp	3663.00		NIST

Cheméo can also estimate Normal Boiling Point Temperature, Normal melting (fusion) point, Critical Temperature, Critical Pressure, Critical Volume, Enthalpy of formation at standard conditions, Enthalpy of vaporization at standard conditions, Standard Gibbs free energy of formation, Acentric Factor, Ionization energy, Log10 of Water solubility in mol/l 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[1081.08; 1108.50]	J/mol×K	[1088.16; 1332.89]
Cp,gas	1081.08	J/mol×K	1088.16	Joback Calculated Property
Cp,gas	1089.35	J/mol×K	1128.95	Joback Calculated Property
Cp,gas	1096.05	J/mol×K	1169.74	Joback Calculated Property
Cp,gas	1101.26	J/mol×K	1210.52	Joback Calculated Property
Cp,gas	1105.03	J/mol×K	1251.31	Joback Calculated Property
Cp,gas	1107.42	J/mol×K	1292.10	Joback Calculated Property
Cp,gas	1108.50	J/mol×K	1332.89	Joback Calculated Property
η	[0.0000126; 0.0001200]	Pa×s	[667.50; 1088.16]
η	0.0001200	Pa×s	667.50	Joback Calculated Property
η	0.0000689	Pa×s	737.61	Joback Calculated Property
η	0.0000436	Pa×s	807.72	Joback Calculated Property
η	0.0000296	Pa×s	877.83	Joback Calculated Property
η	0.0000213	Pa×s	947.94	Joback Calculated Property
η	0.0000161	Pa×s	1018.05	Joback Calculated Property
η	0.0000126	Pa×s	1088.16	Joback Calculated Property

Similar Compounds

Find more compounds similar to Sebacic acid, di(2,3-dichlorobenzyl) ester.

Sources

• Cheméo Relay (1.0)
• Cheméo Relay (1.0, beta) Beta: served but experimental, data-limited and below our cross-validation release bar; the Joback value is recommended where available.
• 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.
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