ChemSpider 2D Image | (2Z)-1-[4-(Dimethylamino)phenyl]-3-(3-pyridinyl)-2-propen-1-one | C16H16N2O

(2Z)-1-[4-(Dimethylamino)phenyl]-3-(3-pyridinyl)-2-propen-1-one

  • Molecular FormulaC16H16N2O
  • Average mass252.311 Da
  • Monoisotopic mass252.126266 Da
  • ChemSpider ID128531956

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-1-[4-(Dimethylamino)phenyl]-3-(3-pyridinyl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-1-[4-(Dimethylamino)phenyl]-3-(3-pyridinyl)-2-propen-1-one [ACD/IUPAC Name]
(2Z)-1-[4-(Diméthylamino)phényl]-3-(3-pyridinyl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-[4-(dimethylamino)phenyl]-3-(3-pyridinyl)-, (2Z)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 433.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.2±28.7 °C
Index of Refraction: 1.639
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 2.77
ACD/BCF (pH 5.5): 74.72
ACD/KOC (pH 5.5): 756.62
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 76.99
ACD/KOC (pH 7.4): 779.63
Polar Surface Area: 33 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 221.0±3.0 cm3

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