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Substance Name: Hexanoic acid, 2-phenyl-, 3-(diethylamino)propyl ester, hydrochloride
RN: 3620-54-0
InChIKey: DBNPXCOZOJRRIZ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H31-N-O2.Cl-H

Molecular Weight

  • 341.92
 
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Names and Synonyms

Synonyms

  • 3-(Diethylamino)propyl 2-phenylhexanoate hydrochloride
  • alpha-Phenyl-caproate du diethylamino-propanolchlorhydrate
  • alpha-Phenyl-caproate du diethylamino-propanolchlorhydrate [French]
  • Propanol, 3-(diethylamino)-, 2-phenylhexanoate, hydrochloride

Systematic Name

  • Hexanoic acid, 2-phenyl-, 3-(diethylamino)propyl ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 3620-54-0

System Generated Number

  • 0003620540

Molecular Formulas

Molecular Formula

  • C19-H31-N-O2.Cl-H

Molecular Formula Fragments

  • C19-H31-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H31NO2.ClH/c1-4-7-14-18(17-12-9-8-10-13-17)19(21)22-16-11-15-20(5-2)6-3;/h8-10,12-13,18H,4-7,11,14-16H2,1-3H3;1H

InChIKey

DBNPXCOZOJRRIZ-UHFFFAOYSA-N

Smiles

C([C@@H](CCCC)c1ccccc1)(=O)OCCCN(CC)CC.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intradermal 500mg/kg (500mg/kg) BEHAVIORAL: EXCITEMENT

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: ATAXIA
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 59, Pg. 149, 1938.