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Substance Name: Dodecanonitrile, l2-fluoro-
RN: 334-71-4
InChIKey: CXKXDUIIHKJROU-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H22-F-N

Molecular Weight

  • 199.3108
 
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Names and Synonyms

Synonyms

  • 12-Fluorododecanonitrile
  • 4-02-00-01105 (Beilstein Handbook Reference)
  • BRN 1765899

Systematic Name

  • Dodecanonitrile, l2-fluoro-

Registry Numbers

CAS Registry Number

  • 334-71-4

System Generated Number

  • 0000334714

Structure Descriptors

InChI

1S/C12H22FN/c13-11-9-7-5-3-1-2-4-6-8-10-12-14/h1-11H2

InChIKey

CXKXDUIIHKJROU-UHFFFAOYSA-N

Smiles

C(CCCCCC#N)CCCCCF

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 80mg/kg (80mg/kg)   Journal of the American Chemical Society. Vol. 78, Pg. 3484, 1956.
mouse LD50 subcutaneous 80mg/kg (80mg/kg)   Compilation of LD50 Values of New Drugs.