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Substance Name: 3-Pyridinemethanethiol
RN: 17617-05-9
InChIKey: MBXKCLHOVPXMCJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H7-N-S

Molecular Weight

  • 125.194
 
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Names and Synonyms

Synonyms

  • 3-(Mercaptomethyl)pyridine
  • 3-Pyridylmethanethiol
  • 3-Pyridylmethyl mercaptan
  • 5-21-02-00184 (Beilstein Handbook Reference)
  • 5-Mercaptomethyl-pyridin
  • 5-Mercaptomethyl-pyridin [German]
  • 5-Mercaptomethylpyridine
  • BRN 0001870
  • Pyridine, 3-mercaptomethyl-

Systematic Name

  • 3-Pyridinemethanethiol

Registry Numbers

CAS Registry Number

  • 17617-05-9

System Generated Number

  • 0017617059

Structure Descriptors

InChI

1S/C6H7NS/c8-5-6-2-1-3-7-4-6/h1-4,8H,5H2

InChIKey

MBXKCLHOVPXMCJ-UHFFFAOYSA-N

Smiles

c1c(cccn1)CS

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 184mg/kg (184mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 238, Pg. 116, 1960.
mouse LD50 intravenous 100mg/kg (100mg/kg)   Pharmazie. Vol. 11, Pg. 242, 1956.