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Substance Name: Propiolonitrile, phenyl-
RN: 935-02-4
InChIKey: IYXVSRXFGYDNEV-UHFFFAOYSA-N

Molecular Formula

  • C9-H5-N

Molecular Weight

  • 127.146
 
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Names and Synonyms

Synonyms

  • 2-Propynenitrile, 3-phenyl-
  • 4-09-00-02329 (Beilstein Handbook Reference)
  • AI3-11802
  • BRN 0386022
  • Cyanophenylacetylene
  • NSC 71547
  • Phenylpropiolique nitrile
  • Phenylpropiolique nitrile [French]
  • Phenylpropiolonitrile
  • Phenylpropynenitrile

Systematic Names

  • 2-Propynenitrile, 3-phenyl-
  • Propiolonitrile, phenyl-

Registry Numbers

CAS Registry Number

  • 935-02-4

System Generated Number

  • 0000935024

Structure Descriptors

InChI

1S/C9H5N/c10-8-4-7-9-5-2-1-3-6-9/h1-3,5-6H

InChIKey

IYXVSRXFGYDNEV-UHFFFAOYSA-N

Smiles

C(C#N)#Cc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
guinea pig LDLo subcutaneous 110mg/kg (110mg/kg)   Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 153, Pg. 895, 1911.
mouse LD50 oral 113mg/kg (113mg/kg)   Pharmacochemistry Library. Vol. 8, Pg. 73, 1985.
rabbit LDLo intravenous 10mg/kg (10mg/kg)   Comptes Rendus Hebdomadaires des Seances, Academie des Sciences. Vol. 153, Pg. 895, 1911.