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Substance Name: Phosphine oxide, diphenyl((alpha-phenyl-alpha-((2-diethylamino)ethyl))benzyl)-hydrochloride
RN: 51749-94-1
InChIKey: XNMZRRWROZEWFR-UHFFFAOYSA-N

Molecular Formula

  • C31-H34-N-O-P.Cl-H

Molecular Weight

  • 504.051
 
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Names and Synonyms

Synonyms

  • 1-(1,1-Diphenyl-3-diethylaminopropyl)diphenylphosphine oxide hydrochloride
  • Phosphine oxide, diphenyl((1,1-diphenyl-3-diethylamino)propyl)-, hydrochloride

Systematic Name

  • Phosphine oxide, diphenyl((alpha-phenyl-alpha-((2-diethylamino)ethyl))benzyl)-hydrochloride

Registry Numbers

CAS Registry Number

  • 51749-94-1

System Generated Number

  • 0051749941

Molecular Formulas

Molecular Formula

  • C31-H34-N-O-P.Cl-H

Molecular Formula Fragments

  • C31-H34-N-O-P
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C31H34NOP.ClH/c1-3-32(4-2)26-25-31(27-17-9-5-10-18-27,28-19-11-6-12-20-28)34(33,29-21-13-7-14-22-29)30-23-15-8-16-24-30;/h5-24H,3-4,25-26H2,1-2H3;1H

InChIKey

XNMZRRWROZEWFR-UHFFFAOYSA-N

Smiles

C(CCN(CC)CC)(c1ccccc1)(c1ccccc1)P(=O)(c1ccccc1)c1ccccc1.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 76mg/kg (76mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 120, 1974.