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Substance Name: 5-Benzoxazoleacetic acid, 2-(2,5-dichlorophenyl)-alpha-methyl-
RN: 54785-36-3
InChIKey: HBEKAGCZHXXNAZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H11-Cl2-N-O3

Molecular Weight

  • 336.1729
 
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Names and Synonyms

Synonyms

  • 2-(2,5-Dichlorophenyl)-alpha-methyl-5-benzoxazoleacetic acid
  • BRN 1024793

Systematic Name

  • 5-Benzoxazoleacetic acid, 2-(2,5-dichlorophenyl)-alpha-methyl-

Registry Numbers

CAS Registry Number

  • 54785-36-3

System Generated Number

  • 0054785363

Structure Descriptors

InChI

1S/C16H11Cl2NO3/c1-8(16(20)21)9-2-5-14-13(6-9)19-15(22-14)11-7-10(17)3-4-12(11)18/h2-8H,1H3,(H,20,21)

InChIKey

HBEKAGCZHXXNAZ-UHFFFAOYSA-N

Smiles

CC(c1ccc2c(c1)nc(o2)c3cc(ccc3Cl)Cl)C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1600mg/kg (1600mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 53, 1975.