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Substance Name: 1,2-Benzisoxazole-7-acetic acid, 3-(p-chlorophenyl)-
RN: 56394-89-9
InChIKey: QBMKKLPAYGGRRP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H10-Cl-N-O3

Molecular Weight

  • 287.701
 
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Names and Synonyms

Synonyms

  • 3-(p-Chlorophenyl)-1,2-benzisoxazole-7-acetic acid
  • BRN 1005608

Systematic Name

  • 1,2-Benzisoxazole-7-acetic acid, 3-(p-chlorophenyl)-

Registry Numbers

CAS Registry Number

  • 56394-89-9

System Generated Number

  • 0056394899

Structure Descriptors

InChI

1S/C15H10ClNO3/c16-11-6-4-9(5-7-11)14-12-3-1-2-10(8-13(18)19)15(12)20-17-14/h1-7H,8H2,(H,18,19)

InChIKey

QBMKKLPAYGGRRP-UHFFFAOYSA-N

Smiles

c1cc(c2c(c1)c(no2)c3ccc(cc3)Cl)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 600mg/kg (600mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 1554, 1979.