Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Quinacainol
RN: 86073-85-0
InChIKey: OPNPUTUBENWDBA-UHFFFAOYSA-N

Molecular Weight

  • 326.481
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • Quinacainol

Synonyms

  • 1-(4-(2-tert-Butylquinolyl))-3-(4-piperidyl)propanol
  • PK 10139
  • RP 54272

Systematic Name

  • 4-Quinolinemethanol, 2-(1,1-dimethylethyl)-alpha-(2-(4-piperidinyl)ethyl)-

Registry Numbers

CAS Registry Number

  • 86073-85-0

System Generated Number

  • 0086073850

Structure Descriptors

InChI

1S/C21H30N2O/c1-21(2,3)20-14-17(16-6-4-5-7-18(16)23-20)19(24)9-8-15-10-12-22-13-11-15/h4-7,14-15,19,22,24H,8-13H2,1-3H3

InChIKey

OPNPUTUBENWDBA-UHFFFAOYSA-N

Smiles

CC(C)(C)c1cc(c2ccccc2n1)C(CCC3CCNCC3)O

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.63 (none)   EXP
Water Solubility 69.4 mg/L 25 EST
Vapor Pressure 5.71E-11 mm Hg 25 EST
Henry's Law Constant 3.91E-14 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.42E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.