CHEBI:28139 - bis(4-chlorophenyl)acetic acid

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ChEBI Name bis(4-chlorophenyl)acetic acid ChEBI ID CHEBI:28139 Definition A organochlorine compound comprising acetic acid having two 4-chlorophenyl substituents attached at the 2-position. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:22891, CHEBI:3118 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 C14H10Cl2O2 Net Charge 0 Average Mass 281.13400 Monoisotopic Mass 280.00579 InChI InChI=1S/C14H10Cl2O2/c15-11-5-1-9(2-6-11)13(14(17)18)10-3-7-12(16)8-4-10/h1-8,13H,(H,17,18) InChIKey YIOCIFXUGBYCJR-UHFFFAOYSA-N SMILES OC(=O)C(c1ccc(Cl)cc1)c1ccc(Cl)cc1 Roles Classification Chemical Role(s): Bronsted acid A molecular entity capable of donating a hydron to an acceptor (Bronsted base). (via oxoacid ) View more via ChEBI Ontology ChEBI Ontology Outgoing bis(4-chlorophenyl)acetic acid (CHEBI:28139) has functional parent acetic acid (CHEBI:15366) bis(4-chlorophenyl)acetic acid (CHEBI:28139) is a monocarboxylic acid (CHEBI:25384) bis(4-chlorophenyl)acetic acid (CHEBI:28139) is a monochlorobenzenes (CHEBI:83403) Synonyms Sources 2,2-Bis(4-chlorophenyl)acetic acid ChemIDplus 2,2-Bis(p-chlorophenyl)acetic acid NIST Chemistry WebBook bis(4-chlorophenyl)acetic acid ChEBI Bis(p-chlorophenyl)acetic acid ChemIDplus Bis(p-chlorphenyl)essigsäure ChemIDplus DDA KEGG COMPOUND Di(p-chlorophenyl)acetic acid ChemIDplus Dichlorodiphenylacetic acid ChemIDplus p,p'-DDA ChemIDplus p,p'-Dichlorodiphenylacetic acid NIST Chemistry WebBook Manual Xref Database C06640 KEGG COMPOUND View more database links Registry Numbers Types Sources 1913593 Reaxys Registry Number Reaxys 83-05-6 CAS Registry Number KEGG COMPOUND 83-05-6 CAS Registry Number NIST Chemistry WebBook Citations Types Sources 12630463 PubMed citation Europe PMC 15563196 PubMed citation Europe PMC 17051774 PubMed citation Europe PMC 17668921 PubMed citation Europe PMC 17912692 PubMed citation Europe PMC 18754456 PubMed citation Europe PMC 7763292 PubMed citation Europe PMC 9175721 PubMed citation Europe PMC Last Modified 24 October 2014