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Substance Name: Benzeneboronic acid, cyclic ((p-chlorophenoxy)methyl)ethylene ester
RN: 2170-24-3
InChIKey: XSLLVTCJWSNEBR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H14-B-Cl-O3

Molecular Weight

  • 288.537
 
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Names and Synonyms

Synonyms

  • 1,3,2-Dioxaborolane, 4-((4-chlorophenoxy)methyl)-2-phenyl-
  • 1,3-Dioxa-2-boracyclopentane, 4-((p-chlorophenoxy)methyl)-2-phenyl-
  • BRN 0551982
  • T-855

Systematic Name

  • Benzeneboronic acid, cyclic ((p-chlorophenoxy)methyl)ethylene ester

Registry Numbers

CAS Registry Number

  • 2170-24-3

System Generated Number

  • 0002170243

Structure Descriptors

InChI

1S/C15H14BClO3/c17-13-6-8-14(9-7-13)18-10-15-11-19-16(20-15)12-4-2-1-3-5-12/h1-9,15H,10-11H2

InChIKey

XSLLVTCJWSNEBR-UHFFFAOYSA-N

Smiles

O1B(O[C@@H](C1)COc1ccc(cc1)Cl)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 430mg/kg (430mg/kg)   Acta Poloniae Pharmaceutica Vol. 25, Pg. 95, 1968.