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CHEBI:64511 - thianthrene

ChEBI IDCHEBI:64511
ChEBI Namethianthrene
Stars
DefinitionThe organosulfur heterocyclic compound that is the parent compound of the thianthrenes, a tricyclic structure comprising two benzene rings fused to the b and e sides of 1,4-dithin.
Last Modified14 May 2012
SubmitterColin Batchelor
DownloadsMolfile
FormulaC12H8S2
Net Charge0
Average Mass216.330
Monoisotopic Mass216.00674
SMILESc1ccc2c(c1)Sc1ccccc1S2
InChIInChI=1S/C12H8S2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H
InChIKeyGVIJJXMXTUZIOD-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
thianthrene (CHEBI:64511) is a mancude organic heterotricyclic parent (CHEBI:36416)
thianthrene (CHEBI:64511) is a organosulfur heterocyclic compound (CHEBI:38106)
thianthrene (CHEBI:64511) is a thianthrenes (CHEBI:64513)
Incoming Relation(s)
mesulfen (CHEBI:134995) is a thianthrene (CHEBI:64511)
Synonyms  Source
9,10-DithiaanthraceneChemIDplus
ThianthrenChEBI
ThiaanthreneChEBI
diphenylene disulfideChEBI
diphenylene disulphideChEBI
dibenzo-1,4-dithiinChEBI
Registry NumbersSources
Reaxys:83046Reaxys
CAS:92-85-3ChemIDplus
CAS:92-85-3NIST Chemistry WebBook
Citations