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CHEBI:86194 - 4-(diethylamino)benzaldehyde

ChEBI IDCHEBI:86194
ChEBI Name4-(diethylamino)benzaldehyde
Stars
DefinitionA member of the class of benzaldehydes carrying a diethylamino substituent at position 4.
Last Modified13 July 2015
SubmitterCeri
DownloadsMolfile
FormulaC11H15NO
Net Charge0
Average Mass177.247
Monoisotopic Mass177.11536
SMILES[H]C(=O)c1ccc(N(CC)CC)cc1
InChIInChI=1S/C11H15NO/c1-3-12(4-2)11-7-5-10(9-13)6-8-11/h5-9H,3-4H2,1-2H3
InChIKeyMNFZZNNFORDXSV-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor  An EC 1.2.1.* (oxidoreductase acting on donor aldehyde/oxo group with NAD+ or NADP+ as acceptor) inhibitor that interferes with the action of aldehyde dehydrogenase (NAD+), EC 1.2.1.3.
ChEBI Ontology
Outgoing Relation(s)
4-(diethylamino)benzaldehyde (CHEBI:86194) has role EC 1.2.1.3 [aldehyde dehydrogenase (NAD+)] inhibitor (CHEBI:35487)
4-(diethylamino)benzaldehyde (CHEBI:86194) is a aromatic amine (CHEBI:33860)
4-(diethylamino)benzaldehyde (CHEBI:86194) is a benzaldehydes (CHEBI:22698)
4-(diethylamino)benzaldehyde (CHEBI:86194) is a tertiary amino compound (CHEBI:50996)
IUPAC Name 
4-(diethylamino)benzaldehyde
Synonyms  Source
4-diethylaminobenzaldehydeSUBMITTER
p-Formyl-N,N-diethylanilineChemIDplus
p-(Diethylamino)benzaldehydeChemIDplus
4-(N,N-Diethylamino)benzaldehydeNIST Chemistry WebBook
Manual XrefsDatabases
3W9PDBeChem
Registry NumbersSources
Reaxys:511102Reaxys
CAS:120-21-8ChemIDplus
CAS:120-21-8NIST Chemistry WebBook
Citations