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Substance Name: Propionic acid, 2-methyl-2-((piperidinomethyl)thio)-
RN: 91017-08-2
InChIKey: NEHWDLUEJCEYRF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H19-N-O2-S

Molecular Weight

  • 217.3311
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2-((piperidinomethyl)thio)propionic acid
  • 5-20-02-00302 (Beilstein Handbook Reference)
  • BRN 4733329

Systematic Name

  • Propionic acid, 2-methyl-2-((piperidinomethyl)thio)-

Registry Numbers

CAS Registry Number

  • 91017-08-2

System Generated Number

  • 0091017082

Structure Descriptors

InChI

1S/C10H19NO2S/c1-10(2,9(12)13)14-8-11-6-4-3-5-7-11/h3-8H2,1-2H3,(H,12,13)

InChIKey

NEHWDLUEJCEYRF-UHFFFAOYSA-N

Smiles

CC(C)(C(=O)O)SCN1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 630mg/kg (630mg/kg)   Bollettino Chimico Farmaceutico. Vol. 103, Pg. 414, 1964.