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Substance Name: Cinnamic acid, p-(bis(2-fluoroethyl)amino)-
RN: 4093-13-4
InChIKey: LPQKXKSZIYNKSF-ZZXKWVIFSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H15-F2-N-O2

Molecular Weight

  • 255.262
 
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Names and Synonyms

Synonyms

  • BRN 2812521
  • NSC 82837
  • p-(Bis-(2-fluoroethyl)-amino)cinnamic acid

Systematic Name

  • Cinnamic acid, p-(bis(2-fluoroethyl)amino)-

Registry Numbers

CAS Registry Number

  • 4093-13-4

System Generated Number

  • 0004093134

Structure Descriptors

InChI

1S/C13H15F2NO2/c14-7-9-16(10-8-15)12-4-1-11(2-5-12)3-6-13(17)18/h1-6H,7-10H2,(H,17,18)/b6-3+

InChIKey

LPQKXKSZIYNKSF-ZZXKWVIFSA-N

Smiles

c1(N(CCF)CCF)ccc(\C=C\C(O)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02294,
rat LD10 intraperitoneal 3800ug/kg (3.8mg/kg)   Journal of Medicinal Chemistry. Vol. 8, Pg. 741, 1965.