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

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ChEBI Name 2-methyl-4-phenyl-2-butanol
ChEBI ID CHEBI:195767
Definition A tertiary alcohol that is benzene substituted by a 3-hydroxy-3-methylbutyl group.
Stars This entity has been manually annotated by the ChEBI Team.
Submitter MetaboLights
Supplier Information No supplier information found for this compound.
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Formula C11H16O
Net Charge 0
Average Mass 164.248
Monoisotopic Mass 164.12012
InChI InChI=1S/C11H16O/c1-11(2,12)9-8-10-6-4-3-5-7-10/h3-7,12H,8-9H2,1-2H3
InChIKey YXVSKJDFNJFXAJ-UHFFFAOYSA-N
SMILES CC(C)(O)CCC1=CC=CC=C1
Roles Classification
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.
fragrance
A substance, extract, or preparation for diffusing or imparting an agreeable or attractive smell.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing 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 Sources
1,1-dimethyl-3-phenyl-1-propanol NIST Chemistry WebBook
1,1-dimethyl-3-phenylpropanol NIST Chemistry WebBook
1,1-dimethyl-3-phenylpropyl alcohol NIST Chemistry WebBook
1-phenyl-3-methylbutan-3-ol ChEBI
2-(2-phenylethyl)-2-propanol ChEBI
2-hydroxy-2-methyl-4-phenylbutane ChEBI
2-phenethyl-2-propanol NIST Chemistry WebBook
2-phenylethyldimethylcarbinol ChEBI
4-phenyl-2-hydroxy-2-methylbutane ChEBI
4-phenyl-2-methyl-2-butanol ChEBI
α,α-dimethyl-γ-phenylpropyl alcohol NIST Chemistry WebBook
α,α-dimethylbenzenepropanol ChEBI
benzyl-tert-butanol ChEBI
dimethyl-β-phenylethylcarbinol ChEBI
dimethylphenethylcarbinol ChEBI
FEMA 3629 ChEBI
Muguet carbinol ChEBI
phenylethyl dimethyl carbinol ChEBI
Manual Xrefs Databases
7350 ChemSpider
FDB008550 FooDB
HMDB0031866 HMDB
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Registry Numbers Types Sources
103-05-9 CAS Registry Number NIST Chemistry WebBook
2076770 Reaxys Registry Number Reaxys
Citation Waiting for Citations Type Source
22036982 PubMed citation Europe PMC
Last Modified
22 January 2024