ChemSpider 2D Image | 4-(4-Bromophenyl)-1-{(2E)-3-[4-(dimethylamino)phenyl]-2-propen-1-yl}-4-piperidinol | C22H27BrN2O

4-(4-Bromophenyl)-1-{(2E)-3-[4-(dimethylamino)phenyl]-2-propen-1-yl}-4-piperidinol

  • Molecular FormulaC22H27BrN2O
  • Average mass415.367 Da
  • Monoisotopic mass414.130676 Da
  • ChemSpider ID22825678

  • Double-bond stereo - Double-bond stereo

More details:

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

4-(4-Bromophenyl)-1-{(2E)-3-[4-(dimethylamino)phenyl]-2-propen-1-yl}-4-piperidinol [ACD/IUPAC Name]
4-(4-Bromophényl)-1-{(2E)-3-[4-(diméthylamino)phényl]-2-propén-1-yl}-4-pipéridinol [French] [ACD/IUPAC Name]
4-(4-Bromphenyl)-1-{(2E)-3-[4-(dimethylamino)phenyl]-2-propen-1-yl}-4-piperidinol [German] [ACD/IUPAC Name]
4-Piperidinol, 4-(4-bromophenyl)-1-[(2E)-3-[4-(dimethylamino)phenyl]-2-propen-1-yl]- [ACD/Index Name]
4-(4-BROMOPHENYL)-1-[(2E)-3-[4-(DIMETHYLAMINO)PHENYL]PROP-2-EN-1-YL]PIPERIDIN-4-OL
4-(4-bromophenyl)-1-{3-[4-(dimethylamino)phenyl]-2-propen-1-yl}-4-piperidinol

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

Density: 1.3±0.1 g/cm3
Boiling Point: 551.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.5±3.0 kJ/mol
Flash Point: 287.3±30.1 °C
Index of Refraction: 1.642
Molar Refractivity: 114.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.23
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 1.56
ACD/KOC (pH 5.5): 7.85
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 75.84
ACD/KOC (pH 7.4): 380.60
Polar Surface Area: 27 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 317.7±3.0 cm3

Click to predict properties on the Chemicalize site


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