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Substance Name: 1,3-Dithiolane, 2,4-dimethyl-2-styryl-
RN: 83521-84-0
InChIKey: JXRTZSAHWJTXMC-AATRIKPKSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H16-S2

Molecular Weight

  • 236.401
 
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Names and Synonyms

Synonyms

  • 2,4-Dimethyl-2-styryl-1,3-dithiolane
  • BRN 5516125

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 83521-84-0

System Generated Number

  • 0083521840

Structure Descriptors

InChI

1S/C13H16S2/c1-10-3-4-12(11(2)9-10)5-6-13-14-7-8-15-13/h3-6,9,13H,7-8H2,1-2H3/b6-5+

InChIKey

JXRTZSAHWJTXMC-AATRIKPKSA-N

Smiles

c1(\C=C\C2SCCS2)c(cc(C)cc1)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.