CHEBI:28200 - 2-chloroethanol

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ChEBI Name 2-chloroethanol ChEBI ID CHEBI:28200 Definition A chloroethanol carrying a chloro substituent at position 2. Stars This entity has been manually annotated by the ChEBI Team. Secondary ChEBI IDs CHEBI:19507, CHEBI:1044 Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C2H5ClO Net Charge 0 Average Mass 80.51320 Monoisotopic Mass 80.00289 InChI InChI=1S/C2H5ClO/c3-1-2-4/h4H,1-2H2 InChIKey SZIFAVKTNFCBPC-UHFFFAOYSA-N SMILES OCCCl Roles Classification Biological Role(s): xenobiotic metabolite Any metabolite produced by metabolism of a xenobiotic compound. View more via ChEBI Ontology ChEBI Ontology Outgoing 2-chloroethanol (CHEBI:28200) has role xenobiotic metabolite (CHEBI:76206) 2-chloroethanol (CHEBI:28200) is a chloroethanol (CHEBI:23141) IUPAC Name 2-chloroethanol Synonyms Sources 2-Chloroethanol KEGG COMPOUND 2-chloroethanol UniProt 2-chloroethyl alcohol NIST Chemistry WebBook β-chloroethanol NIST Chemistry WebBook β-chloroethyl alcohol NIST Chemistry WebBook Ethylene chlorohydrin KEGG COMPOUND Glycol chlorohydrin KEGG COMPOUND Manual Xrefs Databases 2-Chloroethanol Wikipedia c0005 UM-BBD C06753 KEGG COMPOUND View more database links Registry Numbers Types Sources 107-07-3 CAS Registry Number KEGG COMPOUND 107-07-3 CAS Registry Number ChemIDplus 107-07-3 CAS Registry Number NIST Chemistry WebBook 25389 Gmelin Registry Number Gmelin 878139 Beilstein Registry Number Beilstein 878139 Reaxys Registry Number Reaxys Citations Types Sources 20056735 PubMed citation Europe PMC 21266185 PubMed citation Europe PMC 767010 PubMed citation Europe PMC 7766127 PubMed citation Europe PMC 8462123 PubMed citation Europe PMC Last Modified 06 May 2015