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Substance Name: 1,3-Dithiolane, 2-benzyl-2-methyl-
RN: 20137-72-8
InChIKey: LNZSIRYZTYDEDF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C11-H14-S2

Molecular Weight

  • 210.364
 
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Names and Synonyms

Synonyms

  • 2-Benzyl-2-methyl-1,3-dithiolane
  • 5-19-01-00482 (Beilstein Handbook Reference)
  • BRN 1342958

Systematic Name

  • 1,3-Dithiolane, 2-benzyl-2-methyl-

Registry Numbers

CAS Registry Number

  • 20137-72-8

System Generated Number

  • 0020137728

Structure Descriptors

InChI

1S/C11H14S2/c1-11(12-7-8-13-11)9-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3

InChIKey

LNZSIRYZTYDEDF-UHFFFAOYSA-N

Smiles

C1(Cc2ccccc2)(SCCS1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1gm/kg (1000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 235, 1982.