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Predicted properties of the compound entered.

ID QKSKPIVNLNLAAV-UHFFFAOYSA-N
Formula C4H8Cl2S
IUPAC Name 1-chloro-2-[(2-chloroethyl)sulfanyl]ethane
SMILES
Standard InChI
Standard InChIKey
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Other Names and Identifiers
Standard InChI (User Input) InChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2
Standard InChIKey (User Input) InChIKey=QKSKPIVNLNLAAV-UHFFFAOYSA-N
Non-Standard InChI
Non-Standard InChIKey
Other Names and Identifiers 1-chloro-2-(2-chloroethylsulfanyl)ethane | 1-chloro-2-(2-chloroethylthio)ethane | 39472-40-7 | 505-60-2 | 68157-62-0 | 69020-37-7 | 1,1'-Thiobis(2-chloroethane) | 1-Chloro-2-(beta-chloroethylthio)ethane | 2,2'-Dichlorodiethyl sulfide | 2,2'-Dichlorodiethyl sulphide | 2,2'-Dichloroethyl sulfide | 2,2'-Dichloroethyl sulphide | 4-01-00-01407 (Beilstein Handbook Reference) | BIS(2-CHLOROETHYL)SULFIDE | BRN 1733595 | Bis(2-chloroethyl) sulfide | Bis(2-chloroethyl)sulphide | Bis(beta-chloroethyl)sulfide | Bis(beta-chloroethyl)sulphide | CCRIS 570 | Di-2-chloroethyl sulfide | Di-2-chloroethyl sulphide | Dichlorodiethyl sulfide | Dichloroethyl sulfide [Forbidden] | Diethyl sulfide, 2,2'-dichloro | Distilled mustard | Ethane, 1,1'-thiobis(2-chloro- | Gelbkreuz | Gelbkreuz [Czech] | HD | HSDB 336 | Kampstoff "lost" | Lost | Mustard HD | Mustard gas | Mustard vapor | Mustard, sulfur | S mustard | S-Lost | S-Yperite | Schwefel-lost | Senfgas | Sulfide, bis(2-chloroethyl) | Sulfur mustard | Sulfur mustard gas | Sulphur mustard | Sulphur mustard gas | Yellow Cross Gas | Yellow cross liquid | Yperite | beta,beta'-Dichloroethyl sulfide | beta,beta'-Dichloroethyl sulphide | beta,beta-Dichlor-ethyl-sulphide | 1-chloro-2-[(2-chloroethyl)sulfanyl]ethane | 1-chloro-2-[(2-chloroethyl)thio]ethane | CHEBI:25434 | bis(2-chloroethyl) sulphide | bis(2-chloroethyl)sulfane
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Property Value Unit Accuracy
Absolute Entropy of Ideal Gas at 298.15K and 1bar - - -
Acentric Factor - - -
Critical Compressibility Factor - - -
Critical Pressure - - -
Critical Temperature - - -
Critical Volume - - -
Enthalpy of Formation for Ideal Gas at 298.15K - - -
Liquid Molar Volume at 298.15K - - -
Molecular Weight - - -
Net Standard State Enthalpy of Combustion at 298.15K - - -
Normal Boiling Point - - -
Melting Point - - -
Refractive Index - - -
Solubility Parameter at 298.15K - - -
Standard State Absolute Entropy at 298.15K and 1bar - - -
Standard State Enthalpy of Formation at 298.15K and 1bar - - -
Magnetic Susceptibility - - -
Polarizability - - -
Flash Point - - -
Parachor - - -
Lower Flammability Limit Temperature - - -
Lower Flammability Limit Volume Percent - - -
Upper Flammability Limit Temperature - - -
Upper Flammability Limit Volume Percent - - -
Liquid Density at Normal Boiling Point - - -
Heat of Vaporization at 298.15K - - -
Heat of Vaporization at Normal Boiling Point - - -
Water Solubility - - -
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13C NMR prediction -
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