EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:30856 - thiophene

ChEBI IDCHEBI:30856
ChEBI Namethiophene
Stars
DefinitionA monocyclic heteroarene that is furan in which the oxygen atom is replaced by a sulfur.
Last Modified18 June 2019
SubmitterKirill Degtyarenko
DownloadsMolfile
FormulaC4H4S
Net Charge0
Average Mass84.143
Monoisotopic Mass84.00337
SMILESc1ccsc1
InChIInChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H
InChIKeyYTPLMLYBLZKORZ-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
Application:
ChEBI Ontology
Outgoing Relation(s)
thiophene (CHEBI:30856) has role non-polar solvent (CHEBI:48355)
thiophene (CHEBI:30856) is a mancude organic heteromonocyclic parent (CHEBI:35555)
thiophene (CHEBI:30856) is a monocyclic heteroarene (CHEBI:38179)
thiophene (CHEBI:30856) is a thiophenes (CHEBI:26961)
thiophene (CHEBI:30856) is a volatile organic compound (CHEBI:134179)
Incoming Relation(s)
2-methylthiophene (CHEBI:141567) has functional parent thiophene (CHEBI:30856)
thiophene oxide (CHEBI:36603) has functional parent thiophene (CHEBI:30856)
3-formylthiophene (CHEBI:87611) has parent hydride thiophene (CHEBI:30856)
thienyl group (CHEBI:37991) is substituent group from thiophene (CHEBI:30856)
IUPAC Name 
thiophene
Synonyms  Source
thiofuranNIST Chemistry WebBook
ThiophenNIST Chemistry WebBook
Manual XrefsDatabases
ThiopheneWikipedia
HMDB0029718HMDB
Registry NumbersSources
Gmelin:26113Gmelin
Reaxys:103222Reaxys
CAS:110-02-1ChemIDplus
CAS:110-02-1NIST Chemistry WebBook
Citations