Chemical Properties of Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, dibutyl ester (CAS 1770-80-5)

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

CAS

1770-80-5

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_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).
• 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

Temperature Dependent Properties

Property	Value	Unit	Temperature (K)	Source
Cp,gas	[913.49; 1110.08]	J/mol×K	[979.10; 1214.37]
Cp,gas	913.49	J/mol×K	979.10	Joback Calculated Property
Cp,gas	939.11	J/mol×K	1018.31	Joback Calculated Property
Cp,gas	967.08	J/mol×K	1057.52	Joback Calculated Property
Cp,gas	997.79	J/mol×K	1096.74	Joback Calculated Property
Cp,gas	1031.60	J/mol×K	1135.95	Joback Calculated Property
Cp,gas	1068.91	J/mol×K	1175.16	Joback Calculated Property
Cp,gas	1110.08	J/mol×K	1214.37	Joback Calculated Property

Similar Compounds

Find more compounds similar to Bicyclo[2.2.1]hept-5-ene-2,3-dicarboxylic acid, 1,4,5,6,7,7-hexachloro-, dibutyl 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.