CHEBI:76287 - pentachloroethane

Main

ChEBI Ontology

Automatic Xrefs

Reactions

Pathways

Models

ChEBI Name pentachloroethane ChEBI ID CHEBI:76287 Definition A member of the class of chloroethanes that is ethane in which five of the six hydrogens are replaced by chlorines. A non-flammable, high-boiling liquid (b.p. 161-162°C) with relative density 1.67 and an odour resembling that of chloroform, it is used as a solvent for oil and grease, in metal cleaning, and in the separation of coal from impurities. 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 C2HCl5 Net Charge 0 Average Mass 202.29400 Monoisotopic Mass 199.85209 InChI InChI=1S/C2HCl5/c3-1(4)2(5,6)7/h1H InChIKey BNIXVQGCZULYKV-UHFFFAOYSA-N SMILES ClC(Cl)C(Cl)(Cl)Cl Roles Classification Chemical Role(s): non-polar solvent Application(s): non-polar solvent View more via ChEBI Ontology ChEBI Ontology Outgoing pentachloroethane (CHEBI:76287) has role non-polar solvent (CHEBI:48355) pentachloroethane (CHEBI:76287) is a chloroethanes (CHEBI:36016) IUPAC Name 1,1,1,2,2-pentachloroethane Synonyms Sources 1,1,1,2,2-pentachloro-ethane KEGG COMPOUND CCl3CHCl2 ChEBI CHCl2CCl3 NIST Chemistry WebBook Cl3CCHCl2 ChEBI EINECS 200-925-1 ChemIDplus ethane pentachloride NIST Chemistry WebBook pentalin ChemIDplus Manual Xrefs Databases C19496 KEGG COMPOUND PENTACHLOROETHANE MetaCyc View more database links Registry Numbers Types Sources 1736845 Reaxys Registry Number Reaxys 76-01-7 CAS Registry Number ChemIDplus 76-01-7 CAS Registry Number NIST Chemistry WebBook Citations Types Sources 10476437 PubMed citation Europe PMC 12778204 PubMed citation Europe PMC 2576814 PubMed citation Europe PMC 2916082 PubMed citation Europe PMC 3473034 PubMed citation Europe PMC 5171121 PubMed citation Europe PMC 8637849 PubMed citation Europe PMC Last Modified 28 July 2014