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Substance Name: Phenol, 3-(3-(1-allyl-3-methylpiperidinyl))-, hydrochloride
RN: 6580-98-9
InChIKey: XENTXPNRZSWWMF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H21-N-O.Cl-H

Molecular Weight

  • 267.798
 
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Names and Synonyms

Synonyms

  • 1-Allyl-3-(p-hydroxyphenyl)-3-methylpiperidine, hydrochloride
  • 3-(3-(1-Allyl-3-methylpiperidinyl))phenol, hydrochloride
  • Piperidine, 1-allyl-3-(p-hydroxyphenyl)-3-methyl-, hydrochloride

Systematic Name

  • Phenol, 3-(3-(1-allyl-3-methylpiperidinyl))-, hydrochloride

Registry Numbers

CAS Registry Number

  • 6580-98-9

System Generated Number

  • 0006580989

Molecular Formulas

Molecular Formula

  • C15-H21-N-O.Cl-H

Molecular Formula Fragments

  • C15-H21-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C15H21NO.ClH/c1-3-9-16-10-5-8-15(2,12-16)13-6-4-7-14(17)11-13;/h3-4,6-7,11,17H,1,5,8-10,12H2,2H3;1H

InChIKey

XENTXPNRZSWWMF-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)[C@@]1(C[N@@](CCC1)CC=C)C)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous 265mg/kg (265mg/kg)   Journal of Medicinal Chemistry. Vol. 7, Pg. 298, 1964.