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Substance Name: 1,3-Oxathiolane, 2-methyl-2-phenyl-
RN: 5684-32-2
InChIKey: IGPBFEYOHBVXTP-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H12-O-S

Molecular Weight

  • 180.27
 
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Names and Synonyms

Synonyms

  • 2-Methyl-2-phenyl-1,3-oxathiolane
  • 5-19-01-00467 (Beilstein Handbook Reference)
  • BRN 0125506
  • NSC 404009

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 5684-32-2

System Generated Number

  • 0005684322

Structure Descriptors

InChI

1S/C10H12OS/c1-10(11-7-8-12-10)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3

InChIKey

IGPBFEYOHBVXTP-UHFFFAOYSA-N

Smiles

S1[C@@](OCC1)(c1ccccc1)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 17, Pg. 235, 1982.