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CHEBI:53239 - dibenzothiazol-2-yl disulfide

ChEBI IDCHEBI:53239
ChEBI Namedibenzothiazol-2-yl disulfide
Stars
DefinitionAn organic disulfide resulting from the formal oxidative coupling of the thiol groups of two molecules of 1,3-benzothiazole-2-thiol. It is used as an accelerator in the rubber industry.
Last Modified16 January 2014
Submitterzjosephs
DownloadsMolfile
FormulaC14H8N2S4
Net Charge0
Average Mass332.500
Monoisotopic Mass331.95703
SMILESc1ccc2sc(SSc3nc4ccccc4s3)nc2c1
InChIInChI=1S/C14H8N2S4/c1-3-7-11-9(5-1)15-13(17-11)19-20-14-16-10-6-2-4-8-12(10)18-14/h1-8H
InChIKeyAFZSMODLJJCVPP-UHFFFAOYSA-N
Roles Classification
Biological Role:
allergen  A chemical compound, or part thereof, which causes the onset of an allergic reaction by interacting with any of the molecular pathways involved in an allergy.
ChEBI Ontology
Outgoing Relation(s)
dibenzothiazol-2-yl disulfide (CHEBI:53239) has functional parent 1,3-benzothiazole-2-thiol (CHEBI:34292)
dibenzothiazol-2-yl disulfide (CHEBI:53239) has role allergen (CHEBI:50904)
dibenzothiazol-2-yl disulfide (CHEBI:53239) is a benzothiazoles (CHEBI:37947)
dibenzothiazol-2-yl disulfide (CHEBI:53239) is a organic disulfide (CHEBI:35489)
IUPAC Name 
2,2'-dithiobis(1,3-benzothiazole)
Synonyms  Source
2,2'-Benzothiazyl disulfideChemIDplus
2,2'-Bis(benzothiazolyl) disulfideChemIDplus
2,2'-Dibenzothiazyl disulfideChemIDplus
2-Mercaptobenzothiazole disulfideChemIDplus
Benzothiazole disulfideChemIDplus
benzothiazolyl disulfideChemIDplus
Manual XrefsDatabases
CN1827608Patent
EP0112794Patent
EP0135102Patent
EP0392052Patent
Registry NumbersSources
Reaxys:285796Reaxys
CAS:120-78-5ChemIDplus
CAS:120-78-5NIST Chemistry WebBook
Citations