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Substance Name: 2-(tert-Butylthio)benzothiazole
RN: 39543-16-3
UNII: DJP3029XXT
InChIKey: OBNJMMOIUUIFCV-UHFFFAOYSA-N

Molecular Formula

  • C11-H13-N-S2

Molecular Weight

  • 223.363
 
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Names and Synonyms

Name of Substance

  • 2-(tert-Butylthio)benzothiazole

Synonyms

  • 2-tert-Butylthiobenzothiazole
  • Benzothiazole, 2-(tert-butylthio)-
  • BRN 1211328
  • NSC 202404
  • UNII-DJP3029XXT

Systematic Names

  • Benzothiazole, 2-((1,1-dimethylethyl)thio)- (9CI)
  • Benzothiazole, 2-(tert-butylthio)-

Registry Numbers

CAS Registry Number

  • 39543-16-3

FDA UNII

  • DJP3029XXT

System Generated Number

  • 0039543163

Structure Descriptors

InChI

1S/C11H13NS2/c1-11(2,3)14-10-12-8-6-4-5-7-9(8)13-10/h4-7H,1-3H3

InChIKey

OBNJMMOIUUIFCV-UHFFFAOYSA-N

Smiles

c1(nc2ccccc2s1)SC(C)(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 56mg/kg (56mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#05361,