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Substance Name: Malononitrile, (3-phenyl-2-propynylidene)-
RN: 13532-14-4
InChIKey: XSWQETQYZLSTJB-UHFFFAOYSA-N

Molecular Formula

  • C12-H6-N2

Molecular Weight

  • 178.193
 
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Names and Synonyms

Synonyms

  • 3-Phenyl-2-propynylidenemalononitrile
  • BRN 2575899

Systematic Name

  • Malononitrile, (3-phenyl-2-propynylidene)-

Registry Numbers

CAS Registry Number

  • 13532-14-4

System Generated Number

  • 0013532144

Structure Descriptors

InChI

1S/C12H6N2/c13-9-12(10-14)8-4-7-11-5-2-1-3-6-11/h1-3,5-6,8H

InChIKey

XSWQETQYZLSTJB-UHFFFAOYSA-N

Smiles

c1(C#C\C=C(/C#N)C#N)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 5600ug/kg (5.6mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#07673,