CHEBI:17735 - N,N-dimethylaniline N-oxide

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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 No supplier information found for this compound.
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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 (Bronsted acid).
(via organic amino compound )
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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
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Registry Number Type Source
874-52-2 CAS Registry Number ChemIDplus
Citations Waiting for 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