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Substance Name: 1-Phthalanpropylamine, 3,3-bis(trifluoromethyl)-N,N-dimethyl-1-phenyl-, hydrochloride
RN: 29138-42-9
InChIKey: YPXYVICCGRGENS-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H21-F6-N-O.Cl-H

Molecular Weight

  • 453.852
 
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Names and Synonyms

Synonyms

  • 3,3-Bis(trifluoromethyl)-N,N-dimethyl-1-phenyl-1-phthalanpropylamine hydrochloride
  • LU 6-041 hydrochloride

Systematic Name

  • 1-Phthalanpropylamine, 3,3-bis(trifluoromethyl)-N,N-dimethyl-1-phenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 29138-42-9

System Generated Number

  • 0029138429

Molecular Formulas

Molecular Formula

  • C21-H21-F6-N-O.Cl-H

Molecular Formula Fragments

  • C21-H21-F6-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H21F6NO.ClH/c1-28(2)14-8-13-18(15-9-4-3-5-10-15)16-11-6-7-12-17(16)19(29-18,20(22,23)24)21(25,26)27;/h3-7,9-12H,8,13-14H2,1-2H3;1H

InChIKey

YPXYVICCGRGENS-UHFFFAOYSA-N

Smiles

O1[C@@](c2ccccc2C1(C(F)(F)F)C(F)(F)F)(CCCN(C)C)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 40mg/kg (40mg/kg)   Acta Pharmacologica et Toxicologica. Vol. 28, Pg. 241, 1970.