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Substance Name: Acetophenone, 2-((p-nitrophenyl)thio)-
RN: 33046-48-9
InChIKey: MSDOBISTMBKIFE-UHFFFAOYSA-N

Molecular Formula

  • C14-H11-N-O3-S

Molecular Weight

  • 273.311
 
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Names and Synonyms

Synonyms

  • 3-08-00-00348 (Beilstein Handbook Reference)
  • Acetophenone, 2-((p-nitrophenyl)thio)-
  • BRN 2283563
  • NSC 103612
  • p-Nitrophenylthioacetophenone

Systematic Names

  • Acetophenone, 2-((p-nitrophenyl)thio)-
  • Ethanone, 2-((4-nitrophenyl)thio)-1-phenyl- (9CI)

Registry Numbers

CAS Registry Number

  • 33046-48-9

System Generated Number

  • 0033046489

Structure Descriptors

InChI

1S/C14H11NO3S/c16-14(11-4-2-1-3-5-11)10-19-13-8-6-12(7-9-13)15(17)18/h1-9H,10H2

InChIKey

MSDOBISTMBKIFE-UHFFFAOYSA-N

Smiles

c1(C(CSc2ccc([N+](=O)[O-])cc2)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02272,