CHEBI:144331 - 1-bromo-2-propanol

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ChEBI Name 1-bromo-2-propanol ChEBI ID CHEBI:144331 Definition A secondary alcohol that is propan-2-ol substituted by a bromo group at position 1. Stars This entity has been manually annotated by the ChEBI Team. Submitter Mark Williams 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 C3H7BrO Net Charge 0 Average Mass 138.992 Monoisotopic Mass 137.96803 InChI InChI=1S/C3H7BrO/c1-3(5)2-4/h3,5H,2H2,1H3 InChIKey WEGOLYBUWCMMMY-UHFFFAOYSA-N SMILES BrCC(C)O Metabolite of Species Details Homo sapiens (NCBI:txid9606) Found in umbilical vein endothelial cell line (BTO:0001520). See: MetaboLights Study Roles Classification Biological Role(s): human metabolite Any mammalian metabolite produced during a metabolic reaction in humans (Homo sapiens). View more via ChEBI Ontology ChEBI Ontology Outgoing 1-bromo-2-propanol (CHEBI:144331) has role human metabolite (CHEBI:77746) 1-bromo-2-propanol (CHEBI:144331) is a organobromine compound (CHEBI:37141) 1-bromo-2-propanol (CHEBI:144331) is a secondary alcohol (CHEBI:35681) IUPAC Name 1-bromopropan-2-ol Synonyms Sources 1-bromo-2-hydroxypropane NIST Chemistry WebBook 2-hydroxy-2-methylethyl bromide NIST Chemistry WebBook 2-hydroxybromopropane ChEBI 2-hydroxypropyl bromide ChemIDplus 2-propanol, 1-bromo- ChEBI propylene bromohydrin NIST Chemistry WebBook Registry Numbers Types Sources 1071195 Beilstein Registry Number Beilstein 19686-73-8 CAS Registry Number NIST Chemistry WebBook 19686-73-8 CAS Registry Number ChemIDplus Citations Types Sources 10379989 PubMed citation Europe PMC 16513153 PubMed citation Europe PMC 17093198 PubMed citation Europe PMC 18555422 PubMed citation Europe PMC 24152118 PubMed citation Europe PMC 26525262 PubMed citation Europe PMC 31067084 PubMed citation Europe PMC Last Modified 04 February 2020