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Substance Name: Semicarbazide, 1-(alpha-methylbenzylidene)-3-thio-
RN: 2302-93-4
InChIKey: JMULZUQMMLAALR-YRNVUSSQSA-N

Classification Codes

  • Agricultural Chemical
  • Experimental Pesticide
  • Unspecified / Unclassified Pesticide

Molecular Formula

  • C9-H11-N3-S

Molecular Weight

  • 193.273
 
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Names and Synonyms

Synonyms

  • 1-(alpha-Methylbenzylidene)thiosemicarbizide
  • 4-07-00-00631 (Beilstein Handbook Reference)
  • Acetophenone thiosemicarbazone
  • AI3-22960
  • BRN 2048761
  • NSC 713
  • Semicarbazide, 1-(alpha-methylbenzylidene)-3-thio-

Systematic Names

  • Acetophenone, thiosemicarbazone (8CI)
  • Hydrazinecarbothioamide, 2-(1-phenylethylidene)- (9CI)
  • Semicarbazide, 1-(alpha-methylbenzylidene)-3-thio-

Registry Numbers

CAS Registry Number

  • 2302-93-4

System Generated Number

  • 0002302934

Structure Descriptors

InChI

1S/C9H11N3S/c1-7(11-12-9(10)13)8-5-3-2-4-6-8/h2-6H,1H3,(H3,10,12,13)/b11-7+

InChIKey

JMULZUQMMLAALR-YRNVUSSQSA-N

Smiles

c1(\C(=N\NC(N)=S)C)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#01020,
rat LDLo oral 15mg/kg (15mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 43, 1953.