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Basic Information
CAS No.: 62243-26-9
Name: Diethyl 2,3-dichlorobutanedioate
Article Data: 7
Molecular Structure:
Molecular Structure of 62243-26-9 (Diethyl 2,3-dichlorobutanedioate)
Formula: C8H12Cl2O4
Molecular Weight: 243.087
Synonyms: Butanedioicacid, 2,3-dichloro-, diethyl ester (9CI);Succinic acid, 2,3-dichloro-, diethylester (6CI);Diethyl 2,3-dichlorosuccinate;NSC 7196;
Density: 1.272 g/cm3
Boiling Point: 288.1 °C at 760 mmHg
Flash Point: 113.5 °C
Solubility: 不溶于水
PSA: 52.60000
LogP: 1.32740
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Specification

The CAS register number of Diethyl 2,3-dichlorobutanedioate is 62243-26-9. It also can be called as Butanedioic acid,2,3-dichloro-, 1,4-diethyl ester and the IUPAC name about this chemical is diethyl 2,3-dichlorobutanedioate. The molecular formula about this chemical is C8H12Cl2O4 and the molecular weight is 243.08.

Physical properties about Diethyl 2,3-dichlorobutanedioate are: (1)ACD/LogP: 2.36; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 7; (4)Polar Surface Area: 52.6Å2; (5)Index of Refraction: 1.459; (6)Molar Refractivity: 52.27 cm3; (7)Molar Volume: 191 cm3; (8)Polarizability: 20.72x10-24cm3; (9)Surface Tension: 37 dyne/cm; (10)Enthalpy of Vaporization: 52.73 kJ/mol; (11)Boiling Point: 288.1 °C at 760 mmHg; (12)Vapour Pressure: 0.00239 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: ClC(C(=O)OCC)C(Cl)C(=O)OCC
(2)InChI: InChI=1/C8H12Cl2O4/c1-3-13-7(11)5(9)6(10)8(12)14-4-2/h5-6H,3-4H2,1-2H3
(3)InChIKey: PBGMSGHICSEALQ-UHFFFAOYAN
(4)Std. InChI: InChI=1S/C8H12Cl2O4/c1-3-13-7(11)5(9)6(10)8(12)14-4-2/h5-6H,3-4H2,1-2H3
(5)Std. InChIKey: PBGMSGHICSEALQ-UHFFFAOYSA-N