ChemSpider 2D Image | (2Z)-3-[4-(Dimethylamino)phenyl]-1-(1H-pyrrol-2-yl)-2-propen-1-one | C15H16N2O

(2Z)-3-[4-(Dimethylamino)phenyl]-1-(1H-pyrrol-2-yl)-2-propen-1-one

  • Molecular FormulaC15H16N2O
  • Average mass240.300 Da
  • Monoisotopic mass240.126266 Da
  • ChemSpider ID30655494

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-3-[4-(Dimethylamino)phenyl]-1-(1H-pyrrol-2-yl)-2-propen-1-on [German] [ACD/IUPAC Name]
(2Z)-3-[4-(Dimethylamino)phenyl]-1-(1H-pyrrol-2-yl)-2-propen-1-one [ACD/IUPAC Name]
(2Z)-3-[4-(Diméthylamino)phényl]-1-(1H-pyrrol-2-yl)-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 3-[4-(dimethylamino)phenyl]-1-(1H-pyrrol-2-yl)-, (2Z)- [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: 451.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 226.6±28.7 °C
Index of Refraction: 1.657
Molar Refractivity: 75.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 2.73
ACD/BCF (pH 5.5): 68.00
ACD/KOC (pH 5.5): 694.34
ACD/LogD (pH 7.4): 2.77
ACD/BCF (pH 7.4): 74.68
ACD/KOC (pH 7.4): 762.59
Polar Surface Area: 36 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 206.1±3.0 cm3

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