CHEBI:28094 - 2,2,2-trichloroethanol

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ChEBI Name 2,2,2-trichloroethanol ChEBI ID CHEBI:28094 Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:9685, CHEBI:27098 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 C2H3Cl3O Net Charge 0 Average Mass 149.40272 Monoisotopic Mass 147.92495 InChI InChI=1S/C2H3Cl3O/c3-2(4,5)1-6/h6H,1H2 InChIKey KPWDGTGXUYRARH-UHFFFAOYSA-N SMILES OCC(Cl)(Cl)Cl Metabolite of Species Details Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed Roles Classification Biological Role(s): mouse metabolite Any mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus). View more via ChEBI Ontology ChEBI Ontology Outgoing 2,2,2-trichloroethanol (CHEBI:28094) has role mouse metabolite (CHEBI:75771) 2,2,2-trichloroethanol (CHEBI:28094) is a chloroethanol (CHEBI:23141) IUPAC Name 2,2,2-trichloroethanol Synonyms Sources 2,2,2-trichloro-1-ethanol NIST Chemistry WebBook 2,2,2-Trichloroethanol KEGG COMPOUND Trichloroethanol KEGG COMPOUND Manual Xrefs Databases c0015 UM-BBD C07490 KEGG COMPOUND View more database links Registry Numbers Types Sources 115-20-8 CAS Registry Number ChemIDplus 115-20-8 CAS Registry Number NIST Chemistry WebBook 1697495 Beilstein Registry Number Beilstein 2407 Gmelin Registry Number Gmelin Last Modified 27 January 2016