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Substance Name: Propionic acid, 3,3-diphenyl-, 2-(diethylamino)ethyl ester
RN: 78218-33-4
InChIKey: ASQMSRQTKSSVSW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H27-N-O2

Molecular Weight

  • 325.4493
 
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Names and Synonyms

Synonyms

  • 2-(Diethylamino)ethyl 3,3-diphenylpropionate
  • 3,3-Diphenylpropionic acid 2-(diethylamino)ethyl ester
  • 3-09-00-03339 (Beilstein Handbook Reference)
  • BRN 2291805

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 78218-33-4

System Generated Number

  • 0078218334

Structure Descriptors

InChI

1S/C21H27NO2/c1-3-22(4-2)15-16-24-21(23)17-20(18-11-7-5-8-12-18)19-13-9-6-10-14-19/h5-14,20H,3-4,15-17H2,1-2H3

InChIKey

ASQMSRQTKSSVSW-UHFFFAOYSA-N

Smiles

CCN(CC)CCOC(=O)CC(c1ccccc1)c2ccccc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 125mg/kg (125mg/kg)   Khimiko-Farmatsevticheskii Zhurnal. Chemical Pharmaceutical Journal. For English translation, see PCJOAU. Vol. 1(3), Pg. 3, 1967.
mouse LD50 subcutaneous 370mg/kg (370mg/kg)   Russian Pharmacology and Toxicology Vol. 31, Pg. 53, 1968.