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Substance Name: 5-Benzoxazoleacetic acid, 2-(3-chlorophenyl)-alpha-methyl-
RN: 51234-29-8
InChIKey: GEFRPGHOOMZHRC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H12-Cl-N-O3

Molecular Weight

  • 301.728
 
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Names and Synonyms

Synonyms

  • 2-(3-Chlorophenyl)-alpha-methyl-5-benzoxazoleacetic acid
  • BRN 1085072

Systematic Name

  • 5-Benzoxazoleacetic acid, 2-(3-chlorophenyl)-alpha-methyl-

Registry Numbers

CAS Registry Number

  • 51234-29-8

System Generated Number

  • 0051234298

Structure Descriptors

InChI

1S/C16H12ClNO3/c1-9(16(19)20)10-5-6-14-13(8-10)18-15(21-14)11-3-2-4-12(17)7-11/h2-9H,1H3,(H,19,20)

InChIKey

GEFRPGHOOMZHRC-UHFFFAOYSA-N

Smiles

c12c(oc(n1)c1cc(ccc1)Cl)ccc(c2)[C@@H](C(O)=O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1200mg/kg (1200mg/kg)   Journal of Medicinal Chemistry. Vol. 18, Pg. 53, 1975.