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> Main
CHEBI:64511 - thianthrene
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ChEBI Name
thianthrene
ChEBI ID
CHEBI:64511
Definition
The 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.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Colin Batchelor
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Formula
C12H8S2
Net Charge
0
Average Mass
216.32200
Monoisotopic Mass
216.00674
InChI
InChI=1S/C12H8S2/c1-2-6-10-9(5-1)13-11-7-3-4-8-12(11)14-10/h1-8H
InChIKey
GVIJJXMXTUZIOD-UHFFFAOYSA-N
SMILES
S1c2ccccc2Sc2ccccc12
ChEBI Ontology
Outgoing
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
mesulfen (
CHEBI:134995
)
is a
thianthrene (
CHEBI:64511
)
Synonyms
Sources
9,10-Dithiaanthracene
ChemIDplus
dibenzo-1,4-dithiin
ChEBI
diphenylene disulfide
ChEBI
diphenylene disulphide
ChEBI
Thiaanthrene
ChEBI
Thianthren
ChEBI
Registry Numbers
Types
Sources
83046
Reaxys Registry Number
Reaxys
92-85-3
CAS Registry Number
NIST Chemistry WebBook
92-85-3
CAS Registry Number
ChemIDplus
Citations
Types
Sources
15876074
PubMed citation
Europe PMC
16347697
PubMed citation
Europe PMC
1649441
PubMed citation
Europe PMC
3749607
PubMed citation
Europe PMC
5801386
PubMed citation
Europe PMC
Last Modified
14 May 2012