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Substance Name: Benzeneboronic acid, cyclic ((o-methoxyphenoxy)methyl)ethylene ester
RN: 2412-75-1
InChIKey: JGCDMWRHQDAOBV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H17-B-O4

Molecular Weight

  • 284.117
 
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Names and Synonyms

Synonyms

  • 1,3,2-Dioxaborolane, 4-((2-methoxyphenoxy)methyl)-2-phenyl-
  • 1,3-Dioxa-2-boracyclopentane, 4-((o-methoxyphenoxy)methyl)-2-phenyl-
  • BRN 3037931
  • T-856

Systematic Name

  • Benzeneboronic acid, cyclic ((o-methoxyphenoxy)methyl)ethylene ester

Registry Numbers

CAS Registry Number

  • 2412-75-1

System Generated Number

  • 0002412751

Structure Descriptors

InChI

1S/C16H17BO4/c1-18-15-9-5-6-10-16(15)19-11-14-12-20-17(21-14)13-7-3-2-4-8-13/h2-10,14H,11-12H2,1H3

InChIKey

JGCDMWRHQDAOBV-UHFFFAOYSA-N

Smiles

O1B(O[C@@H](C1)COc1c(cccc1)OC)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 intraperitoneal 940mg/kg (940mg/kg)   Acta Poloniae Pharmaceutica Vol. 25, Pg. 95, 1968.