ChemSpider 2D Image | 3-[(3S)-1-(2-Phenylethyl)-3-piperidinyl]phenol | C19H23NO

3-[(3S)-1-(2-Phenylethyl)-3-piperidinyl]phenol

  • Molecular FormulaC19H23NO
  • Average mass281.392 Da
  • Monoisotopic mass281.177979 Da
  • ChemSpider ID18795922
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

3-[(3S)-1-(2-Phenylethyl)-3-piperidinyl]phenol [German] [ACD/IUPAC Name]
3-[(3S)-1-(2-Phenylethyl)-3-piperidinyl]phenol [ACD/IUPAC Name]
3-[(3S)-1-(2-Phényléthyl)-3-pipéridinyl]phénol [French] [ACD/IUPAC Name]
Phenol, 3-[(3S)-1-(2-phenylethyl)-3-piperidinyl]- [ACD/Index Name]
3-((S)-1-Phenethyl-piperidin-3-yl)-phenol
3-(1-Phenethyl-piperidin-3-yl)-phenol
3-[(3S)-1-(2-phenylethyl)piperidin-3-yl]phenol

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

Density: 1.1±0.1 g/cm3
Boiling Point: 432.6±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.5±3.0 kJ/mol
Flash Point: 212.1±26.0 °C
Index of Refraction: 1.586
Molar Refractivity: 86.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.25
ACD/LogD (pH 7.4): 2.50
ACD/BCF (pH 7.4): 20.35
ACD/KOC (pH 7.4): 113.06
Polar Surface Area: 23 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 44.7±3.0 dyne/cm
Molar Volume: 258.4±3.0 cm3

Click to predict properties on the Chemicalize site






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