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Substance Name: 4-Piperidinol, 1-isopentyl, benzoate, hydrochloride
RN: 78219-60-0
InChIKey: LFAZWNHTBSXWJW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Weight

  • 311.8504
 
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Names and Synonyms

Synonyms

  • 1-Isoamyl-4-piperidyl benzoate hydrochloride
  • Benzoic acid, 1-isopentyl-4-piperidyl ester, hydrochloride

Systematic Name

  • 4-Piperidinol, 1-isopentyl, benzoate, hydrochloride

Registry Numbers

CAS Registry Number

  • 78219-60-0

System Generated Number

  • 0078219600

Molecular Formulas

Molecular Formula

  • C17-H25-N-O2.Cl-H

Molecular Formula Fragments

  • C17-H25-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C17H25NO2.ClH/c1-14(2)8-11-18-12-9-16(10-13-18)20-17(19)15-6-4-3-5-7-15;/h3-7,14,16H,8-13H2,1-2H3;1H

InChIKey

LFAZWNHTBSXWJW-UHFFFAOYSA-N

Smiles

CC(C)CCN1CCC(CC1)OC(=O)c2ccccc2.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 650mg/kg (650mg/kg)   Journal of the American Chemical Society. Vol. 51, Pg. 922, 1929.
rat LD50 intravenous 18mg/kg (18mg/kg)   Journal of the American Chemical Society. Vol. 51, Pg. 922, 1929.