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Substance Name: 1,3-Dithiolane, 2,4-dimethyl-2-propyl-
RN: 98561-12-7
InChIKey: OHERLQGXFAEJFW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H16-S2

Molecular Weight

  • 176.346
 
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Names and Synonyms

Synonyms

  • 2,4-Dimethyl-2-propyl-1,3-dithiolane
  • 4-19-00-00090 (Beilstein Handbook Reference)
  • BRN 0103902

Systematic Name

  • 1,3-Dithiolane, 2,4-dimethyl-2-propyl-

Registry Numbers

CAS Registry Number

  • 98561-12-7

System Generated Number

  • 0098561127

Structure Descriptors

InChI

1S/C8H16S2/c1-4-5-8(3)9-6-7(2)10-8/h7H,4-6H2,1-3H3

InChIKey

OHERLQGXFAEJFW-UHFFFAOYSA-N

Smiles

S1[C@@](SC[C@@H]1C)(CCC)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 235, 1982.