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CHEBI:195767 - 2-methyl-4-phenyl-2-butanol

ChEBI IDCHEBI:195767
ChEBI Name2-methyl-4-phenyl-2-butanol
Stars
DefinitionA tertiary alcohol that is benzene substituted by a 3-hydroxy-3-methylbutyl group.
Last Modified22 January 2024
SubmitterMetaboLights
DownloadsMolfile
FormulaC11H16O
Net Charge0
Average Mass164.248
Monoisotopic Mass164.12012
SMILESCC(C)(O)CCc1ccccc1
InChIInChI=1S/C11H16O/c1-11(2,12)9-8-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3
InChIKeyYXVSKJDFNJFXAJ-UHFFFAOYSA-N
Roles Classification
Biological Role:
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
Applications:
fragrance  A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
flavouring agent  A food additive that is used to added improve the taste or odour of a food.
ChEBI Ontology
Outgoing Relation(s)
2-methyl-4-phenyl-2-butanol (CHEBI:195767) has role flavouring agent (CHEBI:35617)
2-methyl-4-phenyl-2-butanol (CHEBI:195767) has role fragrance (CHEBI:48318)
2-methyl-4-phenyl-2-butanol (CHEBI:195767) is a benzenes (CHEBI:22712)
2-methyl-4-phenyl-2-butanol (CHEBI:195767) is a tertiary alcohol (CHEBI:26878)
IUPAC Name 
2-methyl-4-phenylbutan-2-ol
Synonyms  Source
benzyl-tert-butanolChEBI
phenylethyl dimethyl carbinolChEBI
2-(2-phenylethyl)-2-propanolChEBI
2-hydroxy-2-methyl-4-phenylbutaneChEBI
4-phenyl-2-hydroxy-2-methylbutaneChEBI
dimethylphenethylcarbinolChEBI
Manual XrefsDatabases
HMDB0031866HMDB
7350ChemSpider
FDB008550FooDB
Registry NumbersSources
Reaxys:2076770Reaxys
CAS:103-05-9NIST Chemistry WebBook
Citations