CHEBI:141567 - 2-methylthiophene

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-methylthiophene
ChEBI ID CHEBI:141567
Definition A member of the class of thiophenes that is thiophene in which the hydrogen atom at position 2 is substituted by a methyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information
Download Molfile XML SDF
more structures >>
Formula C5H6S
Net Charge 0
Average Mass 98.167
Monoisotopic Mass 98.01902
InChI InChI=1S/C5H6S/c1-5-3-2-4-6-5/h2-4H,1H3
InChIKey XQQBUAPQHNYYRS-UHFFFAOYSA-N
SMILES CC1=CC=CS1
Roles Classification
Chemical Role(s): Maillard reaction product
Any thermal degradation product obtained as a result of a chemical reaction between an amino acid and a reducing sugar (Maillard reaction, a non-enzymatic browning procedure that usually imparts flavour to starch-based food products).
Biological Role(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application(s): flavouring agent
A food additive that is used to added improve the taste or odour of a food.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 2-methylthiophene (CHEBI:141567) has functional parent thiophene (CHEBI:30856)
2-methylthiophene (CHEBI:141567) has role flavouring agent (CHEBI:35617)
2-methylthiophene (CHEBI:141567) has role Maillard reaction product (CHEBI:77523)
2-methylthiophene (CHEBI:141567) is a thiophenes (CHEBI:26961)
2-methylthiophene (CHEBI:141567) is a volatile organic compound (CHEBI:134179)
IUPAC Name
2-methylthiophene
Synonyms Sources
2-methylthiacyclopentadiene NIST Chemistry WebBook
2-Methylthiophen IUPAC
2-thiotolene ChEBI
Manual Xrefs Databases
21168808 ChemSpider
FDB011118 FooDB
HMDB0033118 HMDB
View more database links
Registry Numbers Types Sources
103734 Reaxys Registry Number Reaxys
554-14-3 CAS Registry Number NIST Chemistry WebBook
554-14-3 CAS Registry Number ChemIDplus
Citation Waiting for Citations Type Source
21889635 PubMed citation Europe PMC
Last Modified
18 June 2019