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Substance Name: Methanethiol, (1-amino-1-cyclopentyl)-, hydrogen sulfate (ester)
RN: 13893-12-4
InChIKey: REBIEXPWHLEQLG-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H13-N-O3-S2

Molecular Weight

  • 211.305
 
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Names and Synonyms

Synonyms

  • BRN 2720831
  • S-1-Aminocyclopentanemethylthiosulfuric acid
  • Thiosulfuric acid, S-(1-amino-1-cyclopentylmethyl) ester
  • WR 2649

Systematic Names

  • Methanethiol, (1-amino-1-cyclopentyl)-, hydrogen sulfate (ester)
  • Thiosulfuric acid (H2S2O3), S-((1-aminocyclopentyl)methyl) ester (9CI)

Registry Numbers

CAS Registry Number

  • 13893-12-4

System Generated Number

  • 0013893124

Structure Descriptors

InChI

1S/C6H13NO3S2/c7-6(3-1-2-4-6)5-11-12(8,9)10/h1-5,7H2,(H,8,9,10)

InChIKey

REBIEXPWHLEQLG-UHFFFAOYSA-N

Smiles

S(=O)(=O)(O)SCC1(CCCC1)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 900mg/kg (900mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 911, 1966.