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> Main
CHEBI:44814 - 4-phenylbutylamine
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ChEBI Name
4-phenylbutylamine
ChEBI ID
CHEBI:44814
Definition
A phenylalkylamine that is benzene in which one of the hydrogens is substituted by a 4-aminobutyl group.
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This entity has been manually annotated by the ChEBI Team.
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Molfile
Formula
C10H15N
Net Charge
0
Average Mass
149.237
Monoisotopic Mass
149.12045
InChI
InChI=1S/C10H15N/c11-9-5-4-8-10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,11H2
InChIKey
AGNFWIZBEATIAK-UHFFFAOYSA-N
SMILES
C=1(C=CC=CC1)CCCCN
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
4-phenylbutylamine (
CHEBI:44814
)
is a
benzenes (
CHEBI:22712
)
4-phenylbutylamine (
CHEBI:44814
)
is a
phenylalkylamine (
CHEBI:60977
)
4-phenylbutylamine (
CHEBI:44814
)
is a
primary amino compound (
CHEBI:50994
)
IUPAC Name
4-phenylbutan-1-amine
Synonyms
Sources
1-amino-4-phenylbutane
NIST Chemistry WebBook
4-amino-1-phenylbutane
NIST Chemistry WebBook
benzenebutanamine
NIST Chemistry WebBook
Manual Xrefs
Databases
DB04311
DrugBank
PBN
PDBeChem
View more database links
Registry Numbers
Types
Sources
13214-66-9
CAS Registry Number
NIST Chemistry WebBook
13214-66-9
CAS Registry Number
ChemIDplus
Citations
Types
Sources
10425374
PubMed citation
Europe PMC
11106506
PubMed citation
Europe PMC
29716210
PubMed citation
Europe PMC
7051703
PubMed citation
Europe PMC
Last Modified
27 May 2020