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CHEBI:184302 - 4-cyanobenzoyl chloride

ChEBI IDCHEBI:184302
ChEBI Name4-cyanobenzoyl chloride
Stars
DefinitionAn acyl chloride consisting of benzoyl chloride in which the hydrogen at position 4 is replaced by a cyano group.
Last Modified26 November 2021
SubmitterJohannes Hunold (ORCID: 0000-0002-4378-6061)
DownloadsMolfile
FormulaC8H4ClNO
Net Charge0
Average Mass165.579
Monoisotopic Mass164.99814
SMILESN#Cc1ccc(C(=O)Cl)cc1
InChIInChI=1S/C8H4ClNO/c9-8(11)7-3-1-6(5-10)2-4-7/h1-4H
InChIKeyUSEDMAWWQDFMFY-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-cyanobenzoyl chloride (CHEBI:184302) has functional parent benzoyl chloride (CHEBI:82275)
4-cyanobenzoyl chloride (CHEBI:184302) is a acyl chloride (CHEBI:36687)
4-cyanobenzoyl chloride (CHEBI:184302) is a benzenes (CHEBI:22712)
4-cyanobenzoyl chloride (CHEBI:184302) is a nitrile (CHEBI:18379)
IUPAC Name 
4-cyanobenzoyl chloride
Synonyms  Source
para-cyanobenzoyl chlorideSUBMITTER
4-(chlorocarbonyl)benzonitrileSUBMITTER
p-cyanobenzoyl chlorideChEBI
4-cyanobenzoic acid chlorideChEBI
Manual XrefsDatabases
72418ChemSpider
Registry NumbersSources
Reaxys:386729Reaxys
CAS:6068-72-0ChemIDplus
Citations