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Substance Name: 1,2-Butanediol, 4-bromo-4,4-dinitro-1-phenyl-
RN: 63732-27-4
InChIKey: DNXJJIZZMJTTAV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H11-Br-N2-O6

Molecular Weight

  • 335.109
 
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Names and Synonyms

Synonyms

  • 1-Brom-1,1-dinitro-4-phenylbutandiol-3,4
  • 3,4-Butanediol, 1-bromo-1,1-dinitro-4-phenyl-
  • Brom-nitrophenidole

Systematic Name

  • 1,2-Butanediol, 4-bromo-4,4-dinitro-1-phenyl-

Registry Numbers

CAS Registry Number

  • 63732-27-4

System Generated Number

  • 0063732274

Structure Descriptors

InChI

1S/C10H11BrN2O6/c11-10(12(16)17,13(18)19)6-8(14)9(15)7-4-2-1-3-5-7/h1-5,8-9,14-15H,6H2

InChIKey

DNXJJIZZMJTTAV-UHFFFAOYSA-N

Smiles

C(C[C@@H]([C@@H](c1ccccc1)O)O)([N+](=O)[O-])([N+](=O)[O-])Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LD50 intraperitoneal 34mg/kg (34mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 199, 1969.
mouse LD50 intraperitoneal 41mg/kg (41mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 199, 1969.
rat LD50 intravenous 25mg/kg (25mg/kg)   Russian Pharmacology and Toxicology Vol. 32, Pg. 199, 1969.