CHEBI:28520 - 2,4,5-trichlorophenol

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ChEBI Name 2,4,5-trichlorophenol ChEBI ID CHEBI:28520 Definition A trichlorophenol carrying chloro groups at positions 2, 4 and 5. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:49904, CHEBI:896, CHEBI:19330 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 C6H3Cl3O Net Charge 0 Average Mass 197.44552 Monoisotopic Mass 195.92495 InChI InChI=1S/C6H3Cl3O/c7-3-1-5(9)6(10)2-4(3)8/h1-2,10H InChIKey LHJGJYXLEPZJPM-UHFFFAOYSA-N SMILES Oc1cc(Cl)c(Cl)cc1Cl ChEBI Ontology Outgoing 2,4,5-trichlorophenol (CHEBI:28520) is a trichlorophenol (CHEBI:27102) IUPAC Name 2,4,5-trichlorophenol Synonyms Sources 2,4,5-TCP ChemIDplus 2,4,5-Trichlorophenol KEGG COMPOUND Manual Xrefs Databases 963 PPDB c0362 UM-BBD C07101 KEGG COMPOUND TC7 PDBeChem View more database links Registry Numbers Types Sources 102425 Gmelin Registry Number Gmelin 607569 Beilstein Registry Number Beilstein 607569 Reaxys Registry Number Reaxys 95-95-4 CAS Registry Number KEGG COMPOUND 95-95-4 CAS Registry Number ChemIDplus 95-95-4 CAS Registry Number NIST Chemistry WebBook Citations Types Sources 24078273 PubMed citation Europe PMC 24361703 PubMed citation Europe PMC 24410196 PubMed citation Europe PMC Last Modified 12 September 2018

General Comment 2014-03-05 It is occasionally found in urine of humans exposed to organochlorine compounds.