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Substance Name: 1,2-Benzisothiazole-3-carboxylic acid
RN: 40991-34-2
InChIKey: KTORKRBAIRTBCP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H5-N-O2-S

Molecular Weight

  • 179.199
 
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Names and Synonyms

Synonyms

  • 2-27-00-00378 (Beilstein Handbook Reference)
  • Acido 3-benzisotiazolcarbossilic
  • Acido 3-benzisotiazolcarbossilic [Italian]
  • BRN 0136252

Systematic Name

  • 1,2-Benzisothiazole-3-carboxylic acid

Registry Numbers

CAS Registry Number

  • 40991-34-2

System Generated Number

  • 0040991342

Structure Descriptors

InChI

1S/C8H5NO2S/c10-8(11)7-5-3-1-2-4-6(5)12-9-7/h1-4H,(H,10,11)

InChIKey

KTORKRBAIRTBCP-UHFFFAOYSA-N

Smiles

s1nc(C(=O)O)c2c1cccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 670mg/kg (670mg/kg)   Farmaco, Edizione Scientifica. Vol. 29, Pg. 109, 1974.