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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:76357 - 2-
tert
-butyl-4-hydroxyanisole
Main
ChEBI Ontology
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ChEBI Name
2-
tert
-butyl-4-hydroxyanisole
ChEBI ID
CHEBI:76357
ChEBI ASCII Name
2-tert-butyl-4-hydroxyanisole
Definition
An aromatic ether that is 4-methoxyphenol in which one of the hydrogens
ortho
- to the methoxy group is replaced by a
tert
-butyl group.
Stars
This entity has been manually annotated by the ChEBI Team.
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Formula
C11H16O2
Net Charge
0
Average Mass
180.24350
Monoisotopic Mass
180.11503
InChI
InChI=1S/C11H16O2/c1-11(2,3)9-7-8(12)5-6-10(9)13-4/h5-7,12H,1-4H3
InChIKey
IMOYOUMVYICGCA-UHFFFAOYSA-N
SMILES
COc1ccc(O)cc1C(C)(C)C
ChEBI Ontology
Outgoing
2-
tert
-butyl-4-hydroxyanisole (
CHEBI:76357
)
is a
aromatic ether (
CHEBI:35618
)
2-
tert
-butyl-4-hydroxyanisole (
CHEBI:76357
)
is a
phenols (
CHEBI:33853
)
Incoming
butylated hydroxyanisole (
CHEBI:76359
)
has part
2-
tert
-butyl-4-hydroxyanisole (
CHEBI:76357
)
IUPAC Name
3-
tert
-butyl-4-methoxyphenol
Synonyms
Sources
2-(1,1-dimethylethyl)-4-hydroxyanisole
ChEBI
2-BHA
ChEBI
2-
tert
-butyl-4-hydroxyanisole
ChemIDplus
2-
tert
-butyl-
p
-hydroxyanisole
ChEBI
3-(1,1-dimethylethyl)-4-methoxyphenol
ChEBI
4-hydroxy-2-
tert
-butylanisole
ChEBI
4-methoxy-3-
tert
-butylphenol
ChEBI
4-methoxy-5-
tert
-butylphenol
ChEBI
m
-
tert
-butyl-
p
-methoxyphenol
ChEBI
p
-methoxy-
m
-
tert
-butylphenol
ChEBI
Manual Xref
Database
HMDB0031848
HMDB
View more database links
Registry Numbers
Types
Sources
2209222
Reaxys Registry Number
Reaxys
88-32-4
CAS Registry Number
NIST Chemistry WebBook
88-32-4
CAS Registry Number
ChemIDplus
Citations
Types
Sources
3201475
PubMed citation
Europe PMC
458807
PubMed citation
Europe PMC
7059997
PubMed citation
Europe PMC
7285002
PubMed citation
Europe PMC
7388831
PubMed citation
Europe PMC
Last Modified
21 November 2013