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Substance Name: alpha-Bromohydrin
RN: 4704-77-2
InChIKey: SIBFQOUHOCRXDL-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Mutation Data

Molecular Formula

  • C3-H7-Br-O2

Molecular Weight

  • 154.99
 
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Names and Synonyms

Name of Substance

  • alpha-Bromohydrin

Synonyms

  • 1-Bromo-2,3-propanediol
  • 2-01-00-00540 (Beilstein Handbook Reference)
  • 3-Bromo-1,2-propanediol
  • alpha-Bromohydrin
  • BRN 1719124
  • Bromodeoxyglycerol
  • EINECS 225-186-2
  • Glycerol bromohydrin
  • Monobromoglycerol

Systematic Names

  • 1,2-Propanediol, 3-bromo-
  • 3-Bromopropane-1,2-diol

Registry Numbers

CAS Registry Number

  • 4704-77-2

System Generated Number

  • 0004704772

Structure Descriptors

InChI

1S/C3H7BrO2/c4-1-3(6)2-5/h3,5-6H,1-2H2

InChIKey

SIBFQOUHOCRXDL-UHFFFAOYSA-N

Smiles

C([C@@H](CBr)O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 212mg/kg (212mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 644, 1977.