CHEBI:76260 - 1-chloropropan-2-ol

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ChEBI Name 1-chloropropan-2-ol ChEBI ID CHEBI:76260 Definition A secondary alcohol that is isopropanol in which one of the methyl hydrogen atoms is substituted by chlorine. 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 C3H7ClO Net Charge 0 Average Mass 94.54000 Monoisotopic Mass 94.01854 InChI InChI=1S/C3H7ClO/c1-3(5)2-4/h3,5H,2H2,1H3 InChIKey YYTSGNJTASLUOY-UHFFFAOYSA-N SMILES CC(O)CCl ChEBI Ontology Outgoing 1-chloropropan-2-ol (CHEBI:76260) has parent hydride propane (CHEBI:32879) 1-chloropropan-2-ol (CHEBI:76260) is a organochlorine compound (CHEBI:36683) 1-chloropropan-2-ol (CHEBI:76260) is a secondary alcohol (CHEBI:35681) IUPAC Name 1-chloropropan-2-ol Synonyms Sources 1-chloro-2-propanol ChEBI 3-chloro-2-propanol ChEBI 3-chloropropan-2-ol ChEBI chloroisopropanol ChEBI chloroisopropyl alcohol ChEBI Registry Number Type Source 773653 Reaxys Registry Number Reaxys Citations Types Sources 12571686 PubMed citation Europe PMC 3142098 PubMed citation Europe PMC 9114330 PubMed citation Europe PMC 931085 PubMed citation Europe PMC Last Modified 14 November 2013