ChemSpider 2D Image | (2Z)-1-(3-Bromophenyl)-3-[4-(dimethylamino)phenyl]-2-propen-1-one | C17H16BrNO

(2Z)-1-(3-Bromophenyl)-3-[4-(dimethylamino)phenyl]-2-propen-1-one

  • Molecular FormulaC17H16BrNO
  • Average mass330.219 Da
  • Monoisotopic mass329.041504 Da
  • ChemSpider ID30655199

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-1-(3-Bromophenyl)-3-[4-(dimethylamino)phenyl]-2-propen-1-one [ACD/IUPAC Name]
(2Z)-1-(3-Bromophényl)-3-[4-(diméthylamino)phényl]-2-propén-1-one [French] [ACD/IUPAC Name]
(2Z)-1-(3-Bromphenyl)-3-[4-(dimethylamino)phenyl]-2-propen-1-on [German] [ACD/IUPAC Name]
2-Propen-1-one, 1-(3-bromophenyl)-3-[4-(dimethylamino)phenyl]-, (2Z)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 466.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 236.0±28.7 °C
Index of Refraction: 1.651
Molar Refractivity: 89.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.49
ACD/LogD (pH 5.5): 4.83
ACD/BCF (pH 5.5): 2732.02
ACD/KOC (pH 5.5): 9833.58
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2929.29
ACD/KOC (pH 7.4): 10543.63
Polar Surface Area: 20 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 48.4±3.0 dyne/cm
Molar Volume: 244.0±3.0 cm3

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