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Substance Name: Phenol, 3-(6-hexyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrochloride, (+-)-
RN: 61098-65-5
InChIKey: JQZKEKIMHYCWBE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H29-N-O.Cl-H

Molecular Weight

  • 323.905
 
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Names and Synonyms

Synonym

  • (+-)-3-(6-Hexyl-6-azabicyclo(3.2.1)oct-1-yl)phenol hydrochloride

Systematic Name

  • Phenol, 3-(6-hexyl-6-azabicyclo(3.2.1)oct-1-yl)-, hydrochloride, (+-)-

Registry Numbers

CAS Registry Number

  • 61098-65-5

System Generated Number

  • 0061098655

Molecular Formulas

Molecular Formula

  • C19-H29-N-O.Cl-H

Molecular Formula Fragments

  • C19-H29-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C19H29NO.ClH/c1-2-3-4-5-12-20-15-19(11-7-9-17(20)14-19)16-8-6-10-18(21)13-16;/h6,8,10,13,17,21H,2-5,7,9,11-12,14-15H2,1H3;1H

InChIKey

JQZKEKIMHYCWBE-UHFFFAOYSA-N

Smiles

CCCCCCN1CC2(CCCC1C2)c3cccc(c3)O.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 subcutaneous > 100mg/kg (100mg/kg)   Journal of Medicinal Chemistry. Vol. 20, Pg. 221, 1977.