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Substance Name: 1,2-Benzisothiazoline-3-acetic acid, sec-butyl ester, 1,1-dioxide
RN: 21416-91-1
InChIKey: YWEPXDSSVKWUKX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H17-N-O4-S

Molecular Weight

  • 283.346
 
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Names and Synonyms

Synonym

  • BRN 1010019

Systematic Name

  • 1,2-Benzisothiazoline-3-acetic acid, sec-butyl ester, 1,1-dioxide

Registry Numbers

CAS Registry Number

  • 21416-91-1

System Generated Number

  • 0021416911

Structure Descriptors

InChI

1S/C13H17NO4S/c1-3-9(2)18-13(15)8-11-10-6-4-5-7-12(10)19(16,17)14-11/h4-7,9,11,14H,3,8H2,1-2H3

InChIKey

YWEPXDSSVKWUKX-UHFFFAOYSA-N

Smiles

c1c2c([C@@H](CC(=O)O[C@@H](CC)C)NS2(=O)=O)ccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 800mg/kg (800mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: CYANOSIS

BEHAVIORAL: ATAXIA
Journal of Pharmaceutical Sciences. Vol. 58, Pg. 332, 1969.