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Substance Name: Diethylaminoethyl diphenylhydroxypropionate hydrochloride [JAN]
RN: 53421-38-8
UNII: 1RU467569N
InChIKey: AABXRENNINHJOR-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Weight

  • 377.909
 
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Names and Synonyms

Name of Substance

  • 3,3-Diphenyl-3-hydroxypropionic acid diethylaminoethyl ester
  • Diethylaminoethyl diphenylhydroxypropionate hydrochloride [JAN]

Synonyms

  • 2-Diethylaminoethyl 3,3-diphenyl-3-hydroxypropionate hydrochloride
  • 3,3-Diphenyl-3-hydroxypropionic acid diethylaminoethyl ester hydrochloride
  • Diethylaminoethyl diphenylhydroxypropionate hydrochloride
  • DPE-HCl
  • UNII-1RU467569N

Systematic Name

  • Hydracrylic acid, 3,3-diphenyl-, 2-(diethylamino)ethyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 53421-38-8

FDA UNII

  • 1RU467569N

System Generated Number

  • 0053421388

Molecular Formulas

Molecular Formula

  • C21-H27-N-O3.Cl-H

Molecular Formula Fragments

  • C21-H27-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H27NO3.ClH/c1-3-22(4-2)15-16-25-20(23)17-21(24,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14,24H,3-4,15-17H2,1-2H3;1H

InChIKey

AABXRENNINHJOR-UHFFFAOYSA-N

Smiles

C(CC(=O)OCCN(CC)CC)(c1ccccc1)(c1ccccc1)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 140mg/kg (140mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 74, Pg. 274, 1942.
mouse LD50 intravenous 27500ug/kg (27.5mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.
mouse LD50 oral 418mg/kg (418mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.
mouse LD50 subcutaneous 280mg/kg (280mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.
rat LD50 intravenous 27500ug/kg (27.5mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.
rat LD50 oral 2310mg/kg (2310mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.
rat LD50 subcutaneous 330mg/kg (330mg/kg)   Drugs in Japan Vol. 6, Pg. 332, 1982.