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Substance Name: Pyridinium, 3-ethoxycarbonyl-1-(2-fluoroethyl)-, bromide
RN: 403-13-4
InChIKey: ZVNLBWUXFPUAKZ-UHFFFAOYSA-M

Molecular Formula

  • C10-H13-F-N-O2.Br

Molecular Weight

  • 278.12
 
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Names and Synonyms

Synonym

  • 3-Carbethoxy-N-2-fluoroethylpyridinium bromide

Systematic Name

  • Pyridinium, 3-ethoxycarbonyl-1-(2-fluoroethyl)-, bromide

Registry Numbers

CAS Registry Number

  • 403-13-4

System Generated Number

  • 0000403134

Molecular Formulas

Molecular Formula

  • C10-H13-F-N-O2.Br

Molecular Formula Fragments

  • Br
  • C10-H13-F-N-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C10H13FNO2.BrH/c1-2-14-10(13)9-4-3-6-12(8-9)7-5-11;/h3-4,6,8H,2,5,7H2,1H3;1H/q+1;/p-1

InChIKey

ZVNLBWUXFPUAKZ-UHFFFAOYSA-M

Smiles

c1(C(=O)OCC)c[n+](CCF)ccc1.[BrH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 200mg/kg (200mg/kg)   Journal of the Chemical Society. Vol. -, Pg. 1279, 1949.