Chemical Properties of Dibutyl chlorendate

InChI

InChI=1S/C17H20Cl6O4/c1-3-5-7-26-13(24)9-10(14(25)27-8-6-4-2)16(21)12(19)11(18)15(9,20)17(16,22)23/h9-10H,3-8H2,1-2H3

InChI Key

UJAHPBDUQZFDLA-UHFFFAOYSA-N

Formula

C17H20Cl6O4

SMILES

CCCCOC(=O)C1C(C(=O)OCCCC)C2(Cl)C(Cl)=C(Cl)C1(Cl)C2(Cl)Cl

Molecular Weight¹

501.06

Other Names

• Chlorendic acid dibutyl ester
• Dibutyl chlorendate
• 5-Norbornene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, dibutyl ester
• dibutyl 1,4,5,6,7,7-hexachlorobicyclo[2.2.1]hept-5-ene-2,3-dicarboxylate

• ω : Acentric Factor.
• C_p,gas : Ideal gas heat capacity (J/mol×K).
• 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).
• 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.

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[894.37; 1063.43]	J/mol×K	[943.16; 1174.07]
Cp,gas	894.37	J/mol×K	943.16	Joback Calculated Property
Cp,gas	916.76	J/mol×K	981.64	Joback Calculated Property
Cp,gas	940.97	J/mol×K	1020.13	Joback Calculated Property
Cp,gas	967.38	J/mol×K	1058.61	Joback Calculated Property
Cp,gas	996.36	J/mol×K	1097.10	Joback Calculated Property
Cp,gas	1028.25	J/mol×K	1135.58	Joback Calculated Property
Cp,gas	1063.43	J/mol×K	1174.07	Joback Calculated Property

Similar Compounds

Find more compounds similar to Dibutyl chlorendate.

Sources

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

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