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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:85505 - 4-ethoxyaniline
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ChEBI Ontology
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ChEBI Name
4-ethoxyaniline
ChEBI ID
CHEBI:85505
Definition
An aromatic ether that is aniline in which the hydrogen at position 4 is replaced by an ethoxy group. It is a hydrolysis metabolite of phenacetin.
Stars
This entity has been manually annotated by the ChEBI Team.
Submitter
Bijay
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Formula
C8H11NO
Net Charge
0
Average Mass
137.17900
Monoisotopic Mass
137.08406
InChI
InChI=1S/C8H11NO/c1-2-10-8-5-3-7(9)4-6-8/h3-6H,2,9H2,1H3
InChIKey
IMPPGHMHELILKG-UHFFFAOYSA-N
SMILES
CCOc1ccc(N)cc1
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
)
Biological Role
(s):
drug metabolite
View more via ChEBI Ontology
ChEBI Ontology
Outgoing
4-ethoxyaniline (
CHEBI:85505
)
has role
drug metabolite (
CHEBI:49103
)
4-ethoxyaniline (
CHEBI:85505
)
is a
aromatic ether (
CHEBI:35618
)
4-ethoxyaniline (
CHEBI:85505
)
is a
primary amino compound (
CHEBI:50994
)
4-ethoxyaniline (
CHEBI:85505
)
is a
substituted aniline (
CHEBI:48975
)
Incoming
phenacetin (
CHEBI:8050
)
has functional parent
4-ethoxyaniline (
CHEBI:85505
)
IUPAC Name
4-ethoxyaniline
Synonyms
Sources
1-amino-4-ethoxybenzene
ChemIDplus
4-aminophenetole
ChemIDplus
4-aminophenyl ethyl ether
ChEBI
4-ethoxybenzenamine
NIST Chemistry WebBook
4-ethoxybenzeneamine
NIST Chemistry WebBook
4-phenetidine
NIST Chemistry WebBook
ethyl
p
-aminophenol
ChemIDplus
p
-aminoethoxybenzene
NIST Chemistry WebBook
p
-aminophenetole
ChemIDplus
p
-aminophenyl ethyl ether
ChEBI
p
-ethoxyaniline
NIST Chemistry WebBook
p
-phenetidine
ChemIDplus
phenetidine
NIST Chemistry WebBook
Manual Xref
Database
CPD0-2528
MetaCyc
View more database links
Registry Numbers
Types
Sources
156-43-4
CAS Registry Number
NIST Chemistry WebBook
156-43-4
CAS Registry Number
ChemIDplus
606666
Reaxys Registry Number
Reaxys
Citations
Types
Sources
11696870
PubMed citation
Europe PMC
14592552
PubMed citation
Europe PMC
1775431
PubMed citation
Europe PMC
2982385
PubMed citation
Europe PMC
6404283
PubMed citation
Europe PMC
6499076
PubMed citation
Europe PMC
Last Modified
21 April 2015