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> Main
CHEBI:30856 - thiophene
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ChEBI Name
thiophene
ChEBI ID
CHEBI:30856
Definition
A monocyclic heteroarene that is furan in which the oxygen atom is replaced by a sulfur.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C4H4S
Net Charge
0
Average Mass
84.14000
Monoisotopic Mass
84.00337
InChI
InChI=1S/C4H4S/c1-2-4-5-3-1/h1-4H
InChIKey
YTPLMLYBLZKORZ-UHFFFAOYSA-N
SMILES
c1ccsc1
Roles Classification
Chemical Role
(s):
non-polar solvent
Application
(s):
non-polar solvent
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
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
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
Sources
thiofuran
NIST Chemistry WebBook
Thiophen
NIST Chemistry WebBook
Manual Xrefs
Databases
HMDB0029718
HMDB
Thiophene
Wikipedia
View more database links
Registry Numbers
Types
Sources
103222
Reaxys Registry Number
Reaxys
103222
Beilstein Registry Number
Beilstein
110-02-1
CAS Registry Number
ChemIDplus
110-02-1
CAS Registry Number
NIST Chemistry WebBook
26113
Gmelin Registry Number
Gmelin
Citations
Types
Sources
11211052
PubMed citation
Europe PMC
15474614
PubMed citation
Europe PMC
Last Modified
18 June 2019