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Substance Name: Ethanethiol, 2-(2-nonyl)amino-, hydrogen sulfate (ester)
RN: 925-36-0
InChIKey: GUQATEKNKSDOJK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H25-N-O3-S2

Molecular Weight

  • 283.454
 
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Names and Synonyms

Synonyms

  • 2-(2-Nonyl)aminoethanethiol hydrogen sulfate (ester)
  • BRN 2368646
  • Ethanethiol, 2-((1-methyloctyl)amino)-, hydrogen sulfate (ester)
  • Thiosulfuric acid, S-(2-((1-methyloctyl)amino)ethyl) ester
  • WR 2709

Systematic Name

  • Ethanethiol, 2-(2-nonyl)amino-, hydrogen sulfate (ester)

Registry Numbers

CAS Registry Number

  • 925-36-0

System Generated Number

  • 0000925360

Structure Descriptors

InChI

1S/C11H25NO3S2/c1-3-4-5-6-7-8-11(2)12-9-10-16-17(13,14)15/h11-12H,3-10H2,1-2H3,(H,13,14,15)

InChIKey

GUQATEKNKSDOJK-UHFFFAOYSA-N

Smiles

S(=O)(=O)(SCCN[C@@H](CCCCCCC)C)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 50mg/kg (50mg/kg)   Journal of Medicinal Chemistry. Vol. 13, Pg. 251, 1970.