EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:156102 - 3-fluorobenzaldehyde

Default Structure
ChEBI IDCHEBI:156102
ChEBI Name3-fluorobenzaldehyde
Stars
DefinitionA member of the class of benzaldehydes that is benzaldehyde substituted by a fluoro group at position 3.
Last Modified13 July 2020
SubmitterAnne Morgat
DownloadsMolfile
FormulaC7H5FO
Net Charge0
Average Mass124.114
Monoisotopic Mass124.03244
SMILES[H]C(=O)c1cccc(F)c1
InChIInChI=1S/C7H5FO/c8-7-3-1-2-6(4-7)5-9/h1-5H
InChIKeyPIKNVEVCWAAOMJ-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
3-fluorobenzaldehyde (CHEBI:156102) is a benzaldehydes (CHEBI:22698)
3-fluorobenzaldehyde (CHEBI:156102) is a monofluorobenzenes (CHEBI:83575)
IUPAC Name 
3-fluorobenzaldehyde
Synonyms  Source
m-fluorobenzaldehydeChemIDplus
meta-fluorobenzaldehydeNIST Chemistry WebBook
UniProt Name  Source
3-fluoro-benzaldehydeUniProt
Manual XrefsDatabases
CPD-8780MetaCyc
Registry NumbersSources
Reaxys:970178Reaxys
CAS:456-48-4NIST Chemistry WebBook
CAS:456-48-4ChemIDplus
Citations