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Substance Name: 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-
RN: 54903-32-1
InChIKey: IXYBEGKDEOTXRD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H12-Cl-N-O3

Molecular Weight

  • 301.7278
 
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Names and Synonyms

Synonyms

  • 6-(3-(4-Chlorophenyl)-1-oxopropyl)-2(3H)-benzoxazolone
  • BRN 1140886
  • JPB 62

Systematic Name

  • 2(3H)-Benzoxazolone, 6-(3-(4-chlorophenyl)-1-oxopropyl)-

Registry Numbers

CAS Registry Number

  • 54903-32-1

System Generated Number

  • 0054903321

Structure Descriptors

InChI

1S/C16H12ClNO3/c17-12-5-1-10(2-6-12)3-8-14(19)11-4-7-13-15(9-11)21-16(20)18-13/h1-2,4-7,9H,3,8H2,(H,18,20)

InChIKey

IXYBEGKDEOTXRD-UHFFFAOYSA-N

Smiles

c1cc(ccc1CCC(=O)c2ccc3c(c2)oc(=O)[nH]3)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 2500mg/kg (2500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 9, Pg. 497, 1974.