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CHEBI:17169 - benzaldehyde

ChEBI IDCHEBI:17169
ChEBI Namebenzaldehyde
Stars
DefinitionAn arenecarbaldehyde that consists of benzene bearing a single formyl substituent; the simplest aromatic aldehyde and parent of the class of benzaldehydes.
Secondary ChEBI IDsCHEBI:3019, CHEBI:13875, CHEBI:22697
Last Modified5 August 2016
DownloadsMolfile

FormulaC7H6O
Net Charge0
Average Mass106.124
Monoisotopic Mass106.04186
SMILES[H]C(=O)c1ccccc1
InChIInChI=1S/C7H6O/c8-6-7-4-2-1-3-5-7/h1-6H
InChIKeyHUMNYLRZRPPJDN-UHFFFAOYSA-N

Wikipedia
Roles Classification

ChEBI Ontology
IUPAC Name 
benzaldehyde
Synonyms  Source
BenzaldehydeKEGG COMPOUND
Benzoic aldehydeKEGG COMPOUND
BenzenecarbonalChemIDplus
Benzene carboxaldehydeChemIDplus
PhenylmethanalChemIDplus
Synthetic oil of bitter almondChemIDplus
UniProt Name  Source
benzaldehydeUniProt
Manual XrefsDatabases
C00261KEGG COMPOUND
C00261KEGG COMPOUND
c0279UM-BBD
D02314KEGG DRUG
HMDB0006115HMDB
BENZALDEHYDEMetaCyc
BenzaldehydeWikipedia
C00193KEGG COMPOUND
HBXPDBeChem
Registry NumbersSources
Reaxys:471223Reaxys
CAS:100-52-7KEGG COMPOUND
CAS:100-52-7ChemIDplus
CAS:100-52-7NIST Chemistry WebBook
Citations