ChemSpider 2D Image | (3R,4r,5S)-3,5-Dimethyl-4-phenyl-4-piperidinol | C13H19NO

(3R,4r,5S)-3,5-Dimethyl-4-phenyl-4-piperidinol

  • Molecular FormulaC13H19NO
  • Average mass205.296 Da
  • Monoisotopic mass205.146667 Da
  • ChemSpider ID59760697

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3R,4r,5S)-3,5-Dimethyl-4-phenyl-4-piperidinol [German] [ACD/IUPAC Name]
(3R,4r,5S)-3,5-Dimethyl-4-phenyl-4-piperidinol [ACD/IUPAC Name]
(3R,4r,5S)-3,5-Diméthyl-4-phényl-4-pipéridinol [French] [ACD/IUPAC Name]
4-Piperidinol, 3,5-dimethyl-4-phenyl-, (3α,4β,5α)- [ACD/Index Name]
(3R,4R,5S)-3,5-Dimethyl-4-Phenylpiperidin-4-Ol
(3r,4r,5s)-3,5-dimethyl-4-phenylpiperidin-4-ol(wxc05295)
C13H19NO
MFCD30472094

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

Density: 1.0±0.1 g/cm3
Boiling Point: 329.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.4±3.0 kJ/mol
Flash Point: 111.0±18.5 °C
Index of Refraction: 1.523
Molar Refractivity: 61.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.46
Polar Surface Area: 32 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 36.4±3.0 dyne/cm
Molar Volume: 202.1±3.0 cm3

Click to predict properties on the Chemicalize site


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