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Substance Name: Butyrophenone, 4'-fluoro-4-(1-pyrrolidinyl)-, maleate
RN: 59921-81-2
InChIKey: MRUYNEGWIFFPAW-BTJKTKAUSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H18-F-N-O.C4-H4-O4

Molecular Weight

  • 351.372
 
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Names and Synonyms

Synonyms

  • 1-(4'-Fluorobenzoil)-3-pirrolidinopropano maleato
  • 1-(4'-Fluorobenzoil)-3-pirrolidinopropano maleato [Italian]
  • 1-(4'-Fluorobenzoyl)-3-pyrrolidinylpropane maleate
  • 4'-Fluoro-4-(1-pyrrolidinyl)butyrophenone maleate

Systematic Name

  • Butyrophenone, 4'-fluoro-4-(1-pyrrolidinyl)-, maleate

Registry Numbers

CAS Registry Number

  • 59921-81-2

System Generated Number

  • 0059921812

Molecular Formulas

Molecular Formula

  • C14-H18-F-N-O.C4-H4-O4

Molecular Formula Fragments

  • C14-H18-F-N-O
  • C4-H4-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C14H18FNO.C4H4O4/c15-13-7-5-12(6-8-13)14(17)4-3-11-16-9-1-2-10-16;5-3(6)1-2-4(7)8/h5-8H,1-4,9-11H2;1-2H,(H,5,6)(H,7,8)/b;2-1-

InChIKey

MRUYNEGWIFFPAW-BTJKTKAUSA-N

Smiles

c1(C(CCC[NH+]2CCCC2)=O)ccc(cc1)F.C(=C/C(=O)[O-])\C(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 47mg/kg (47mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 442, 1976.
mouse LD50 oral 235mg/kg (235mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 442, 1976.
rat LD50 oral 335mg/kg (335mg/kg)   Farmaco, Edizione Scientifica. Vol. 31, Pg. 442, 1976.