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Substance Name: Valeric acid, 2-ethyl-3-methyl-2-phenyl-, 2-(diethylamino)ethyl ester, monohydrochloride
RN: 29620-40-4
InChIKey: XBOKQYSWEHBJPT-UHFFFAOYSA-N

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Weight

  • 355.947
 
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Names and Synonyms

Synonyms

  • 2-Ethyl-3-methyl-2-phenylvaleric acid 2-(diethylamino)ethyl ester hydrochloride
  • Benzeneacetic acid, alpha-ethyl-alpha-(1-methylpropyl)-, 2-(diethylamino)ethyl ester, HCl
  • GP 249 hydrochloride
  • Pentanoic acid, 2-ethyl-3-methyl-2-phenyl-, 2-(diethylamino)ethyl ester, hydrochloride

Systematic Name

  • Valeric acid, 2-ethyl-3-methyl-2-phenyl-, 2-(diethylamino)ethyl ester, monohydrochloride

Registry Numbers

CAS Registry Number

  • 29620-40-4

System Generated Number

  • 0029620404

Molecular Formulas

Molecular Formula

  • C20-H33-N-O2.Cl-H

Molecular Formula Fragments

  • C20-H33-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C20H33NO2.ClH/c1-6-17(5)20(7-2,18-13-11-10-12-14-18)19(22)23-16-15-21(8-3)9-4;/h10-14,17H,6-9,15-16H2,1-5H3;1H

InChIKey

XBOKQYSWEHBJPT-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 33500ug/kg (33.5mg/kg)   Toho Igakkai Zasshi. Journal of Medical Society of Toho University. Vol. 18, Pg. 297, 1971.
rat LD50 intravenous 42100ug/kg (42.1mg/kg)   Toho Igakkai Zasshi. Journal of Medical Society of Toho University. Vol. 18, Pg. 297, 1971.