CHEBI:145958 - 2'-methylacetophenone

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ChEBI Name 2'-methylacetophenone
ChEBI ID CHEBI:145958
Definition A member of the class of acetophenones that is acetophenone which is substituted by a methyl group at position 2.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter Mark Williams
Supplier Information No supplier information found for this compound.
Download Molfile XML SDF
Formula C9H10O
Net Charge 0
Average Mass 134.178
Monoisotopic Mass 134.07316
InChI InChI=1S/C9H10O/c1-7-5-3-4-6-9(7)8(2)10/h3-6H,1-2H3
InChIKey YXWWHNCQZBVZPV-UHFFFAOYSA-N
SMILES O=C(C=1C(=CC=CC1)C)C
Metabolite of Species Details
Penicillium coprophilum (NCBI:txid36646) See: PubMed
Roles Classification
Biological Role(s): fungal metabolite
Any eukaryotic metabolite produced during a metabolic reaction in fungi, the kingdom that includes microorganisms such as the yeasts and moulds.
flavouring agent
A food additive that is used to added improve the taste or odour of a food.
Application(s): acaricide
A substance used to destroy pests of the subclass Acari (mites and ticks).
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'-methylacetophenone (CHEBI:145958) has role acaricide (CHEBI:22153)
2'-methylacetophenone (CHEBI:145958) has role flavouring agent (CHEBI:35617)
2'-methylacetophenone (CHEBI:145958) has role fungal metabolite (CHEBI:76946)
2'-methylacetophenone (CHEBI:145958) is a acetophenones (CHEBI:22187)
2'-methylacetophenone (CHEBI:145958) is a toluenes (CHEBI:27024)
IUPAC Name
1-(2-methylphenyl)ethanone
Synonyms Sources
1-(2-methylphenyl)ethan-1-one IUPAC
1-(2-tolyl)ethanone ChEBI
1-(o-tolyl)ethan-1-one ChEBI
1-(o-tolyl)ethanone ChEBI
2'-methylacetylphenone ChemIDplus
2-acetyltoluene ChemIDplus
2-methylacetophenone ChemIDplus
methyl 2-methylphenyl ketone NIST Chemistry WebBook
methyl o-tolyl ketone ChEBI
o-acetyltoluene ChemIDplus
o-methylacetophenone ChemIDplus
ortho-methylacetophenone ChEBI
Registry Numbers Types Sources
26444-19-9 CAS Registry Number ChemIDplus
577-16-2 CAS Registry Number ChemIDplus
577-16-2 CAS Registry Number NIST Chemistry WebBook
907005 Reaxys Registry Number Reaxys
Citations Types Sources
11073576 PubMed citation Europe PMC
15147713 PubMed citation Europe PMC
20670023 PubMed citation Europe PMC
22429095 PubMed citation Europe PMC
2641484 PubMed citation Europe PMC
6120816 PubMed citation Europe PMC
Last Modified
10 March 2020