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Substance Name: 1-Piperidinepropanol, 2-phenethyl-, benzoate, hydrochloride
RN: 78219-45-1
InChIKey: NSTHKUHNWFVDDL-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N-O2.Cl-H

Molecular Weight

  • 387.948
 
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Names and Synonyms

Synonyms

  • Benzoic acid, 3-(2-phenylethylpiperidino)propyl ester, hydrochloride
  • gamma-2-Phenylethylpiperidinopropyl benzoate hydrochloride

Systematic Name

  • 1-Piperidinepropanol, 2-phenethyl-, benzoate, hydrochloride

Registry Numbers

CAS Registry Number

  • 78219-45-1

System Generated Number

  • 0078219451

Molecular Formulas

Molecular Formula

  • C23-H29-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H29-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H29NO2.ClH/c25-23(21-12-5-2-6-13-21)26-19-9-18-24-17-8-7-14-22(24)16-15-20-10-3-1-4-11-20;/h1-6,10-13,22H,7-9,14-19H2;1H

InChIKey

NSTHKUHNWFVDDL-UHFFFAOYSA-N

Smiles

c1ccc(cc1)CCC2CCCCN2CCCOC(=O)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 15mg/kg (15mg/kg)   Journal of the American Chemical Society. Vol. 52, Pg. 1633, 1930.
mouse LD50 subcutaneous 550mg/kg (550mg/kg)   Journal of the American Chemical Society. Vol. 52, Pg. 1633, 1930.
rat LDLo intravenous 22mg/kg (22mg/kg)   Journal of the American Chemical Society. Vol. 55, Pg. 4625, 1933.