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Substance Name: Cinnamamide, N-allyl-alpha,beta-dimethyl-4-fluoro-, (E)-
RN: 60548-33-6
InChIKey: KLVNOTXOIZUNRN-ZHACJKMWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H16-F-N-O

Molecular Weight

  • 233.284
 
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Names and Synonyms

Synonyms

  • 2-Butenamide, 3-(4-fluorophenyl)-2-methyl-N-2-propenyl-, (E)-
  • trans-N-Allyl-alpha,beta-dimethyl-4-fluorocinnamamide

Systematic Name

  • Cinnamamide, N-allyl-alpha,beta-dimethyl-4-fluoro-, (E)-

Registry Numbers

CAS Registry Number

  • 60548-33-6

System Generated Number

  • 0060548336

Structure Descriptors

InChI

1S/C14H16FNO/c1-4-9-16-14(17)11(3)10(2)12-5-7-13(15)8-6-12/h4-8H,1,9H2,2-3H3,(H,16,17)/b11-10+

InChIKey

KLVNOTXOIZUNRN-ZHACJKMWSA-N

Smiles

c1(\C(=C(\C(NCC=C)=O)C)C)ccc(F)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 400mg/kg (400mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 48, 1977.