ChemSpider 2D Image | 3-[3-(4-Hydroxy-3-methoxy-5-nitrophenyl)acryloyl]-2H-chromen-2-one | C19H13NO7

3-[3-(4-Hydroxy-3-methoxy-5-nitrophenyl)acryloyl]-2H-chromen-2-one

  • Molecular FormulaC19H13NO7
  • Average mass367.309 Da
  • Monoisotopic mass367.069214 Da
  • ChemSpider ID35428328

More details:

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

2H-1-Benzopyran-2-one, 3-[3-(4-hydroxy-3-methoxy-5-nitrophenyl)-1-oxo-2-propen-1-yl]- [ACD/Index Name]
3-[3-(4-Hydroxy-3-methoxy-5-nitrophenyl)acryloyl]-2H-chromen-2-on [German] [ACD/IUPAC Name]
3-[3-(4-Hydroxy-3-methoxy-5-nitrophenyl)acryloyl]-2H-chromen-2-one [ACD/IUPAC Name]
3-[3-(4-Hydroxy-3-méthoxy-5-nitrophényl)acryloyl]-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 592.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.6±3.0 kJ/mol
Flash Point: 312.2±30.1 °C
Index of Refraction: 1.686
Molar Refractivity: 94.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.00
ACD/LogD (pH 5.5): 3.25
ACD/BCF (pH 5.5): 170.13
ACD/KOC (pH 5.5): 1342.20
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 22.96
ACD/KOC (pH 7.4): 181.12
Polar Surface Area: 119 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 69.2±3.0 dyne/cm
Molar Volume: 249.5±3.0 cm3

Click to predict properties on the Chemicalize site


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