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Substance Name: 7-Benzothiazolesulfonic acid, 2-(4-aminophenyl)-6-methyl-
RN: 130-17-6
InChIKey: KGZUHYIHYBDNLC-UHFFFAOYSA-N

Molecular Formula

  • C14-H12-N2-O3-S2

Molecular Weight

  • 320.3918
 
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Names and Synonyms

Synonyms

  • 2-(4-Aminophenyl)-6-methyl-7-benzothiazolesulfonic acid
  • 2-(p-Aminophenyl)-6-methyl-7-benzothiazolesulfonic acid
  • 2-(p-Aminophenyl)-6-methylbenzothiazolyl-7-sulfonic acid
  • 2-27-00-00492 (Beilstein Handbook Reference)
  • 7-Benzothiazolesulfonic acid, 2-(4-aminophenyl)-6-methyl-
  • BRN 0313390
  • Dehydrothio-p-toluidinesulfonic acid
  • EC 204-979-7
  • EINECS 204-979-7
  • NSC 203387
  • NSC 44566
  • p-(6-Methyl-7-sulfobenzothiazole)aniline

Systematic Names

  • 2-(4-Aminophenyl)-6-methylbenzothiazole-7-sulphonic acid
  • 7-Benzothiazolesulfonic acid, 2-(4-aminophenyl)-6-methyl-
  • 7-Benzothiazolesulfonic acid, 2-(p-aminophenyl)-6-methyl-

Registry Numbers

CAS Registry Number

  • 130-17-6

System Generated Number

  • 0000130176

Structure Descriptors

InChI

1S/C14H12N2O3S2/c1-8-2-7-11-12(13(8)21(17,18)19)20-14(16-11)9-3-5-10(15)6-4-9/h2-7H,15H2,1H3,(H,17,18,19)

InChIKey

KGZUHYIHYBDNLC-UHFFFAOYSA-N

Smiles

Cc1ccc2c(c1S(=O)(=O)O)sc(n2)c3ccc(cc3)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 178mg/kg (178mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00718,