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CHEBI:87314 - 4-hydroxy-2-methylacetophenone

ChEBI IDCHEBI:87314
ChEBI Name4-hydroxy-2-methylacetophenone
Stars
DefinitionA member of the class of acetophenones that is acetophenone substituted by a hydroxy group at position 4 and a methyl group at position 2 respectively.
Last Modified2 September 2015
Submitternamrata
DownloadsMolfile
FormulaC9H10O2
Net Charge0
Average Mass150.177
Monoisotopic Mass150.06808
SMILESCC(=O)c1ccc(O)cc1C
InChIInChI=1S/C9H10O2/c1-6-5-8(11)3-4-9(6)7(2)10/h3-5,11H,1-2H3
InChIKeyIAMNVCJECQWBLZ-UHFFFAOYSA-N
Roles Classification
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
4-hydroxy-2-methylacetophenone (CHEBI:87314) has role metabolite (CHEBI:25212)
4-hydroxy-2-methylacetophenone (CHEBI:87314) is a acetophenones (CHEBI:22187)
4-hydroxy-2-methylacetophenone (CHEBI:87314) is a phenols (CHEBI:33853)
IUPAC Name 
1-(4-hydroxy-2-methylphenyl)ethan-1-one
Synonym  Source
1-acetyl-4-hydroxy-2-methylbenzeneChEBI
Registry NumbersSources
Reaxys:2043591Reaxys
CAS:875-59-2ChemIDplus
CAS:875-59-2NIST Chemistry WebBook