ChemSpider 2D Image | [(3S)-1-Isobutyl-3-piperidinyl]methanol | C10H21NO

[(3S)-1-Isobutyl-3-piperidinyl]methanol

  • Molecular FormulaC10H21NO
  • Average mass171.280 Da
  • Monoisotopic mass171.162308 Da
  • ChemSpider ID32798677

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[(3S)-1-Isobutyl-3-piperidinyl]methanol [German] [ACD/IUPAC Name]
[(3S)-1-Isobutyl-3-piperidinyl]methanol [ACD/IUPAC Name]
[(3S)-1-Isobutyl-3-pipéridinyl]méthanol [French] [ACD/IUPAC Name]
3-Piperidinemethanol, 1-(2-methylpropyl)-, (3S)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.9±0.1 g/cm3
Boiling Point: 225.5±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 53.7±6.0 kJ/mol
Flash Point: 73.7±18.5 °C
Index of Refraction: 1.462
Molar Refractivity: 51.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -1.44
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.25
Polar Surface Area: 23 Å2
Polarizability: 20.4±0.5 10-24cm3
Surface Tension: 30.7±3.0 dyne/cm
Molar Volume: 187.1±3.0 cm3

Click to predict properties on the Chemicalize site


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