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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:17735 -
N
,
N
-dimethylaniline
N
-oxide
Main
ChEBI Ontology
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ChEBI Name
N
,
N
-dimethylaniline
N
-oxide
ChEBI ID
CHEBI:17735
ChEBI ASCII Name
N,N-dimethylaniline N-oxide
Definition
A member of the class of dimethylanilines that is
N
,
N
-dimethylaniline in which the tertiary amino group has been oxidised to give the corresponding
N
-oxide.
Stars
This entity has been manually annotated by the ChEBI Team.
Secondary ChEBI IDs
CHEBI:7075, CHEBI:12424, CHEBI:21453
Supplier Information
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Molfile
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Molfile
Formula
C8H11NO
Net Charge
0
Average Mass
137.17908
Monoisotopic Mass
137.08406
InChI
InChI=1S/C8H11NO/c1-9(2,10)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKey
LKQUDAOAMBKKQW-UHFFFAOYSA-N
SMILES
CN(C)(=O)c1ccccc1
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
N
,
N
-dimethylaniline
N
-oxide (
CHEBI:17735
)
has functional parent
N
,
N
-dimethylaniline (
CHEBI:16269
)
N
,
N
-dimethylaniline
N
-oxide (
CHEBI:17735
)
is a
dimethylaniline (
CHEBI:23806
)
N
,
N
-dimethylaniline
N
-oxide (
CHEBI:17735
)
is a
tertiary amine oxide (
CHEBI:134363
)
IUPAC Name
N
,
N
-dimethylaniline
N
-oxide
Synonyms
Sources
dimethyl(phenyl)amine oxide
ChEBI
dimethylaniline
N
-oxide
ChemIDplus
N,N-Dimethylaniline N-oxide
KEGG COMPOUND
N
,
N
-dimethylaniline
N
-oxide
UniProt
Manual Xrefs
Databases
C01183
KEGG COMPOUND
FDB022640
FooDB
HMDB0001466
HMDB
NN-DIMETHYLANILINE-N-OXIDE
MetaCyc
View more database links
Registry Number
Type
Source
874-52-2
CAS Registry Number
ChemIDplus
Citations
Types
Sources
13201
PubMed citation
Europe PMC
2750202
PubMed citation
Europe PMC
4260498
PubMed citation
Europe PMC
6030897
PubMed citation
Europe PMC
6719937
PubMed citation
Europe PMC
Last Modified
23 September 2020