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Substance Name: Acetic acid, 3-benzo(b)thienyl-
RN: 1131-09-5
InChIKey: VFZQJKXVHYZXMM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H8-O2-S

Molecular Weight

  • 192.237
 
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Names and Synonyms

Synonyms

  • 3-Benzo(b)thienylacetic acid
  • 3-Benzo(b)thiopheneacetic acid
  • 5-18-06-00447 (Beilstein Handbook Reference)
  • Acetic acid, 3-benzo(b)thienyl-
  • Benzothiophene-3-acetic acid
  • BRN 0143357
  • EINECS 214-461-2
  • NSC 18875
  • NSC 93635

Systematic Names

  • Acetic acid, 3-benzo(b)thienyl-
  • Benzo(b)thiophene-3-acetic acid

Registry Numbers

CAS Registry Number

  • 1131-09-5

System Generated Number

  • 0001131095

Structure Descriptors

InChI

1S/C10H8O2S/c11-10(12)5-7-6-13-9-4-2-1-3-8(7)9/h1-4,6H,5H2,(H,11,12)

InChIKey

VFZQJKXVHYZXMM-UHFFFAOYSA-N

Smiles

c1(csc2c1cccc2)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Journal of the Chemical Society, Section C: Organic. Vol. (12), Pg. 1612, 1969.
mouse LD50 oral 1500mg/kg (1500mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 598, 1965.