CHEBI:60716 - 4-chlorobenzoyl chloride

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name 4-chlorobenzoyl chloride ChEBI ID CHEBI:60716 Definition An acyl chloride consisting of benzoyl chloride having a chloro substituent in the para-position. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C7H4Cl2O Net Charge 0 Average Mass 175.01200 Monoisotopic Mass 173.96392 InChI InChI=1S/C7H4Cl2O/c8-6-3-1-5(2-4-6)7(9)10/h1-4H InChIKey RKIDDEGICSMIJA-UHFFFAOYSA-N SMILES ClC(=O)c1ccc(Cl)cc1 ChEBI Ontology Outgoing 4-chlorobenzoyl chloride (CHEBI:60716) has functional parent 4-chlorobenzoic acid (CHEBI:30747) 4-chlorobenzoyl chloride (CHEBI:60716) is a acyl chloride (CHEBI:36687) 4-chlorobenzoyl chloride (CHEBI:60716) is a monochlorobenzenes (CHEBI:83403) IUPAC Name 4-chlorobenzoyl chloride Synonyms Sources p-Chlorobenzoyl chloride NIST Chemistry WebBook para-Chlorobenzoyl chloride NIST Chemistry WebBook Registry Numbers Types Sources 122-01-0 CAS Registry Number NIST Chemistry WebBook 122-01-0 CAS Registry Number ChemIDplus 471606 Reaxys Registry Number Reaxys Citations Types Sources 13704282 PubMed citation Europe PMC 7120066 PubMed citation Europe PMC Last Modified 23 October 2014