ChemSpider 2D Image | 3-{3-[4-(Dimethylamino)phenyl]acryloyl}-4-hydroxy-2H-chromen-2-one | C20H17NO4

3-{3-[4-(Dimethylamino)phenyl]acryloyl}-4-hydroxy-2H-chromen-2-one

  • Molecular FormulaC20H17NO4
  • Average mass335.353 Da
  • Monoisotopic mass335.115753 Da
  • ChemSpider ID35462269

More details:

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

2H-1-Benzopyran-2-one, 3-[3-[4-(dimethylamino)phenyl]-1-oxo-2-propen-1-yl]-4-hydroxy- [ACD/Index Name]
3-{3-[4-(Dimethylamino)phenyl]acryloyl}-4-hydroxy-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-{3-[4-(Dimethylamino)phenyl]acryloyl}-4-hydroxy-2H-chromen-2-one [ACD/IUPAC Name]
3-{3-[4-(Diméthylamino)phényl]acryloyl}-4-hydroxy-2H-chromén-2-one [French] [ACD/IUPAC 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: 563.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.1±3.0 kJ/mol
Flash Point: 294.6±30.1 °C
Index of Refraction: 1.698
Molar Refractivity: 95.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 12.38
ACD/KOC (pH 5.5): 102.64
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.09
Polar Surface Area: 67 Å2
Polarizability: 37.9±0.5 10-24cm3
Surface Tension: 65.8±3.0 dyne/cm
Molar Volume: 248.2±3.0 cm3

Click to predict properties on the Chemicalize site


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