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Substance Name: 2-Methyl-2-phenyl-1,3-dithiolane
RN: 5769-02-8
UNII: Y99X08O50E
InChIKey: NCOLUSQXCWLHEK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-S2

Molecular Weight

  • 196.337
 
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Names and Synonyms

Name of Substance

  • 2-Methyl-2-phenyl-1,3-dithiolane

Synonyms

  • 2-Methyl-2-phenyl-1,3-dithiolane
  • NSC 218181
  • UNII-Y99X08O50E

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 5769-02-8

FDA UNII

  • Y99X08O50E

System Generated Number

  • 0005769028

Structure Descriptors

InChI

1S/C10H12S2/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

InChIKey

NCOLUSQXCWLHEK-UHFFFAOYSA-N

Smiles

c1(C2(SCCS2)C)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 400mg/kg (400mg/kg)   Chimica Therapeutica. Vol. 5, Pg. 327, 1970.