ChemSpider 2D Image | 2-{[(2S)-2-(3-Pyridinyl)-1-piperidinyl]methyl}phenol | C17H20N2O

2-{[(2S)-2-(3-Pyridinyl)-1-piperidinyl]methyl}phenol

  • Molecular FormulaC17H20N2O
  • Average mass268.353 Da
  • Monoisotopic mass268.157562 Da
  • ChemSpider ID30825522

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-{[(2S)-2-(3-Pyridinyl)-1-piperidinyl]methyl}phenol [German] [ACD/IUPAC Name]
2-{[(2S)-2-(3-Pyridinyl)-1-piperidinyl]methyl}phenol [ACD/IUPAC Name]
2-{[(2S)-2-(3-Pyridinyl)-1-pipéridinyl]méthyl}phénol [French] [ACD/IUPAC Name]
Phenol, 2-[[(2S)-2-(3-pyridinyl)-1-piperidinyl]methyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 415.7±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.5±3.0 kJ/mol
Flash Point: 205.2±27.3 °C
Index of Refraction: 1.609
Molar Refractivity: 80.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 0.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.65
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 12.25
ACD/KOC (pH 7.4): 140.12
Polar Surface Area: 36 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 231.7±3.0 cm3

Click to predict properties on the Chemicalize site


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