Predicted properties of the compound entered.

ID KFUSEUYYWQURPO-OWOJBTEDSA-N
Formula C2H2Cl2
IUPAC Name (E)-1,2-dichloroethene
SMILES ClC=CCl
Standard InChI InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1+
Standard InChIKey InChIKey=KFUSEUYYWQURPO-OWOJBTEDSA-N
Cite this record http://www.chemrtp.com/chemical-info.ce?ID=KFUSEUYYWQURPO-OWOJBTEDSA-N
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C2H2Cl2/c3-1-2-4/h1-2H/b2-1+
Standard InChIKey (User Input) InChIKey=KFUSEUYYWQURPO-OWOJBTEDSA-N
Non-Standard InChI InChI=1/C2H2Cl2/c3-1-2-4/h1-2H/b2-1+
Non-Standard InChIKey InChIKey=KFUSEUYYWQURPO-OWOJBTEDBH
Other Names and Identifiers 1,2-Dichloroethene | (E)-1,2-Dichloroethene | (E)-1,2-Dichloroethylene | 1,2-Dichloroethylene | 156-60-5 | 540-59-0 | 43695-79-0 | Dichloro-1,2-ethylene [French] | Dioform | EINECS 208-750-2 | Ethene, 1,2-dichloro- | Ethylene, 1,2-dichloro- | HSDB 149 | NCI-C56031 | sym-Dichloroethylene | 1,2-Dichloroethylene (trans) | Dichloroethylene-trans | c0034 | trans-1,2-DCE | 36969_RIEDEL | CHEBI:18882 | 1,2-Dichloroethene, trans- | 4-01-00-00709 (Beilstein Handbook Reference) | AI3-28786 | BRN 1420761 | CCRIS 2505 | EINECS 205-860-2 | Ethene, 1,2-dichloro-, (1E)- | Ethene, 1,2-dichloro-, (E)- (9CI) | Ethylene, 1,2-dichloro-, trans- | HCC 1130t | HSDB 6361 | NSC 60512 | R 1130t | RCRA waste no. U079 | RCRA waste number U079 | ETHENE,1,2-DICHLORO (CIS) | InChI=1/C2H2Cl2/c3-1-2-4/h1-2 | trans-Dichloroethene | InChI=1/C2H2Cl2/c3-1-2-4/h1-2H/b2-1 | cis & trans 1,2-Dichloroethylene | NCGC00091531-02 | D62209_ALDRICH | CHEBI:29027 | 1,2-Dichloraethen | 35140_FLUKA | NCGC00091531-01 | C06791 | trans-1,2-Dichloroethene | trans-Acetylene dichloride | cs & trans 1,2-Dichloroethylene | cis,trans-1,2-Dichloroethylene | 1,2-Dichloroethylene, mixture of cis and trans | D62403_ALDRICH | 48527_SUPELCO | 1,2-trans-Dichloroethylene | 1,trans-2-Dichloroethene | Acetylene dichloride, trans- | Dichloroethylene, trans- | Ethene, 1,2-dichloro-, (E)- | Ethylene, 1,2-dichloro-, (E)- | NSC60512 | WLN: G1U1G-T | trans-1,2-Dichloroethylene | trans-Di-1,2-chloroethylene | trans-Dichloroethylene | 1,2-DCE | 1,2-Dichlor-aethen [German] | 1,2-Dichloroethylene, all isomers | 2-01-00-00158 (Beilstein Handbook Reference) | Acetylene dichloride | BRN 1719345 | CCRIS 6227
For more property data (~2,100 data sets per compound) with higher accuracy , try our new database.
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar71.0841cal/mol/K
Acentric Factor0.188950dimensionless
Critical Compressibility Factor0.256613dimensionless-
Critical Pressure48.4949bar
Critical Temperature514.3914K
Critical Volume2.2631e-4m3/mol
Enthalpy of Formation for Ideal Gas at 298.15K2.1340kcal/mol
Liquid Molar Volume at 298.15K7.5882e-5m3/mol
Molecular Weight96.9427g/mol-
Net Standard State Enthalpy of Combustion at 298.15K-233.2613kcal/mol-
Normal Boiling Point326.8084K
Melting Point195.6437K
Refractive Index1.4483dimensionless
Solubility Parameter at 298.15K8993.925cal(1/2)/m(3/2)
Standard State Absolute Entropy at 298.15K and 1bar45.0819cal/mol/K
Standard State Enthalpy of Formation at 298.15K and 1bar0.876058kcal/mol
Magnetic Susceptibility50.1074ppm
Polarizability8.1240A3
Flash Point284.4523K
Parachor177.4309cm3
Lower Flammability Limit Temperature275.4801K
Lower Flammability Limit Volume Percent9.7010vol%
Upper Flammability Limit Temperature271.0284K
Upper Flammability Limit Volume Percent12.8013vol%
Liquid Density at Normal Boiling Point1.2463e+4mol/m3
Heat of Vaporization at 298.15K7.0026kcal/mol
Heat of Vaporization at Normal Boiling Point6.9355kcal/mol
Water Solubility-1.4138log(mol/L)
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Additional Information Link
1H NMR predictionLink from www.nmrdb.org
13C NMR predictionLink from www.nmrdb.org
COSY predictionnLink from www.nmrdb.org
HSQC/HMBC predictionLink from www.nmrdb.org
All predictionLink from www.nmrdb.org