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Substance Name: 1,3-Propanediol, 2-methyl-2-propyl-, dithiocarbamate
RN: 93047-97-3
InChIKey: RCNVVLVYTNEYNM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H18-N2-O2-S2

Molecular Weight

  • 225.3751
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2-propyl-1,3-propanediol bis(thioncarbamate)
  • BRN 1911863
  • Carbamic acid, thio-, O,O'-(2-methyl-2-propyltrimethylene) ester
  • Thiocarbamic acid, O,O'-(2-methyl-2-propyltrimethylene) ester

Systematic Name

  • 1,3-Propanediol, 2-methyl-2-propyl-, dithiocarbamate

Registry Numbers

CAS Registry Number

  • 93047-97-3

System Generated Number

  • 0093047973

Structure Descriptors

InChI

1S/C7H16O2.CH3NS2/c1-3-4-7(2,5-8)6-9;2-1(3)4/h8-9H,3-6H2,1-2H3;(H3,2,3,4)

InChIKey

RCNVVLVYTNEYNM-UHFFFAOYSA-N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 460mg/kg (460mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 174, 1964.