Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 1,3-Dithiolane, 2-methyl-2-(p-nitrophenyl)-
RN: 41159-13-1
InChIKey: KBQHFQPJKLVEMY-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C10-H11-N-O2-S2

Molecular Weight

  • 241.334
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Synonyms

  • 2-Methyl-2-(p-nitrophenyl)-1,3-dithiolane
  • BRN 5540417

Systematic Name

  • 1,3-Dithiolane, 2-methyl-2-(p-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 41159-13-1

System Generated Number

  • 0041159131

Structure Descriptors

InChI

1S/C10H11NO2S2/c1-10(14-6-7-15-10)8-2-4-9(5-3-8)11(12)13/h2-5H,6-7H2,1H3

InChIKey

KBQHFQPJKLVEMY-UHFFFAOYSA-N

Smiles

c1(C2(SCCS2)C)ccc([N+](=O)[O-])cc1

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.