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Substance Name: Phosphonic acid, (alpha-(2-dimethylamino)ethyl)benzyl-, O,O-diethyl ester, hydrochloride
RN: 51713-19-0
InChIKey: HTGIVSKKVKCWOF-UHFFFAOYSA-N

Molecular Formula

  • C15-H26-N-O3-P.Cl-H

Molecular Weight

  • 335.809
 
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Names and Synonyms

Synonym

  • Diethyl 1-(phenyl-3-dimethylaminopropyl)phosphonate hydrochloride

Systematic Name

  • Phosphonic acid, (alpha-(2-dimethylamino)ethyl)benzyl-, O,O-diethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 51713-19-0

System Generated Number

  • 0051713190

Molecular Formulas

Molecular Formula

  • C15-H26-N-O3-P.Cl-H

Molecular Formula Fragments

  • C15-H26-N-O3-P
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H26NO3P.ClH/c1-5-18-20(17,19-6-2)15(12-13-16(3)4)14-10-8-7-9-11-14;/h7-11,15H,5-6,12-13H2,1-4H3;1H

InChIKey

HTGIVSKKVKCWOF-UHFFFAOYSA-N

Smiles

P([C@@H](CCN(C)C)c1ccccc1)(=O)(OCC)OCC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 597mg/kg (597mg/kg)   Journal of Medicinal Chemistry. Vol. 17, Pg. 120, 1974.