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ChEBI
> Main
CHEBI:132233 - 1-phenylpropan-2-amine
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ChEBI Name
1-phenylpropan-2-amine
ChEBI ID
CHEBI:132233
Definition
A primary amine that is isopropylamine in which a hydrogen attached to one of the methyl groups has been replaced by a phenyl group.
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This entity has been manually annotated by the ChEBI Team.
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Formula
C9H13N
Net Charge
0
Average Mass
135.207
Monoisotopic Mass
135.10480
InChI
InChI=1S/C9H13N/c1-8(10)7-9-5-3-2-4-6-9/h2-6,8H,7,10H2,1H3
InChIKey
KWTSXDURSIMDCE-UHFFFAOYSA-N
SMILES
C=1(C=CC=CC1)CC(C)N
Roles Classification
Chemical Role
(s):
Bronsted base
A molecular entity capable of accepting a hydron from a donor (Br
o
nsted acid).
(via
organic amino compound
)
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
1-phenylpropan-2-amine (
CHEBI:132233
)
is a
primary amine (
CHEBI:32877
)
Incoming
(
R
)-amphetamine (
CHEBI:42724
)
is a
1-phenylpropan-2-amine (
CHEBI:132233
)
(
S
)-amphetamine (
CHEBI:4469
)
is a
1-phenylpropan-2-amine (
CHEBI:132233
)
IUPAC Name
1-phenylpropan-2-amine
Last Modified
05 June 2020
General Comment
2016-06-19
This is the entry for material with unspecified stereochemistry. There are separate entries for the individual enantiomers [(
R
)-amphetamine and (
S
)-amphetamine] and for the racemate (amphetamine).