ChemSpider 2D Image | 7-[(2-Bromo-3,4-dimethoxybenzyl)oxy]-2H-chromen-2-one | C18H15BrO5

7-[(2-Bromo-3,4-dimethoxybenzyl)oxy]-2H-chromen-2-one

  • Molecular FormulaC18H15BrO5
  • Average mass391.213 Da
  • Monoisotopic mass390.010284 Da
  • ChemSpider ID30151688

More details:

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

2H-1-Benzopyran-2-one, 7-[(2-bromo-3,4-dimethoxyphenyl)methoxy]- [ACD/Index Name]
7-[(2-Brom-3,4-dimethoxybenzyl)oxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
7-[(2-Bromo-3,4-dimethoxybenzyl)oxy]-2H-chromen-2-one [ACD/IUPAC Name]
7-[(2-Bromo-3,4-diméthoxybenzyl)oxy]-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: 526.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.1±3.0 kJ/mol
Flash Point: 272.0±30.1 °C
Index of Refraction: 1.608
Molar Refractivity: 92.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.86
ACD/LogD (pH 5.5): 4.42
ACD/BCF (pH 5.5): 1354.07
ACD/KOC (pH 5.5): 6070.52
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 1354.07
ACD/KOC (pH 7.4): 6070.52
Polar Surface Area: 54 Å2
Polarizability: 36.5±0.5 10-24cm3
Surface Tension: 49.7±3.0 dyne/cm
Molar Volume: 266.0±3.0 cm3

Click to predict properties on the Chemicalize site


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