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Substance Name: 1,3-Dithiolane, 2-acetyl-2-methyl-
RN: 33266-07-8
InChIKey: CZFIROOFEBLGGD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C6-H10-O-S2

Molecular Weight

  • 162.276
 
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Names and Synonyms

Synonyms

  • 2-Acetyl-2-methyl-1,3-dithiolane
  • 5-19-04-00040 (Beilstein Handbook Reference)
  • BRN 4306520
  • Ketone, methyl 2-methyl-1,3-dithiolan-2-yl

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 33266-07-8

System Generated Number

  • 0033266078

Structure Descriptors

InChI

1S/C6H10OS2/c1-5(7)6(2)8-3-4-9-6/h3-4H2,1-2H3

InChIKey

CZFIROOFEBLGGD-UHFFFAOYSA-N

Smiles

C1(C(C)=O)(SCCS1)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.