ChemSpider 2D Image | (2E)-1-(2-Hydroxyphenyl)-3-[(3R)-3-phenyl-1-piperidinyl]-2-propen-1-one | C20H21NO2

(2E)-1-(2-Hydroxyphenyl)-3-[(3R)-3-phenyl-1-piperidinyl]-2-propen-1-one

  • Molecular FormulaC20H21NO2
  • Average mass307.386 Da
  • Monoisotopic mass307.157227 Da
  • ChemSpider ID35034989

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-1-(2-Hydroxyphenyl)-3-[(3R)-3-phenyl-1-piperidinyl]-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(2-Hydroxyphenyl)-3-[(3R)-3-phenyl-1-piperidinyl]-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(2-Hydroxyphényl)-3-[(3R)-3-phényl-1-pipéridinyl]-2-propén-1-one [French] [ACD/IUPAC Name]
(2e)-1-(2-Hydroxyphenyl)-3-[(3r)-3-Phenylpiperidin-1-Yl]prop-2-En-1-One
2-Propen-1-one, 1-(2-hydroxyphenyl)-3-[(3R)-3-phenyl-1-piperidinyl]-, (2E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 476.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 242.2±28.7 °C
Index of Refraction: 1.654
Molar Refractivity: 93.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.61
ACD/LogD (pH 5.5): 4.18
ACD/BCF (pH 5.5): 839.96
ACD/KOC (pH 5.5): 4024.63
ACD/LogD (pH 7.4): 4.13
ACD/BCF (pH 7.4): 741.96
ACD/KOC (pH 7.4): 3555.06
Polar Surface Area: 41 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 255.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement