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CHEBI:25434 - bis(2-chloroethyl) sulfide

ChEBI IDCHEBI:25434
ChEBI Namebis(2-chloroethyl) sulfide
Stars
DefinitionAn ethyl sulfide that is diethyl sulfide in which a hydrogen from each of the terminal methyl groups is replaced by a chlorine. It is a powerful vesicant regulated under the Chemical Weapons Convention.
Last Modified28 July 2014
DownloadsMolfile

FormulaC4H8Cl2S
Net Charge0
Average Mass159.081
Monoisotopic Mass157.97238
SMILESClCCSCCCl
InChIInChI=1S/C4H8Cl2S/c5-1-3-7-4-2-6/h1-4H2
InChIKeyQKSKPIVNLNLAAV-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
1-chloro-2-[(2-chloroethyl)sulfanyl]ethane
Synonyms  Source
bis(2-chloroethyl) sulphideNIST Chemistry WebBook
bis(2-chloroethyl) sulfideChemIDplus
mustard gasChemIDplus
1,1'-thiobis(2-chloroethane)NIST Chemistry WebBook
sulfur mustardChemIDplus
bis(2-chloroethyl)sulfaneIUPAC
Manual XrefsDatabases
Sulfur mustardWikipedia
C19164KEGG COMPOUND
Registry NumbersSources
Beilstein:1733595Beilstein
Gmelin:324535Gmelin
CAS:505-60-2ChemIDplus
CAS:505-60-2NIST Chemistry WebBook
CAS:505-60-2KEGG COMPOUND
Citations