ChemSpider 2D Image | 6-Bromo-8-[(4-methoxybenzoyl)amino]-4-oxo-4H-chromene-2-carboxylic acid | C18H12BrNO6

6-Bromo-8-[(4-methoxybenzoyl)amino]-4-oxo-4H-chromene-2-carboxylic acid

  • Molecular FormulaC18H12BrNO6
  • Average mass418.195 Da
  • Monoisotopic mass416.984802 Da
  • ChemSpider ID30830777

More details:

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

4H-1-Benzopyran-2-carboxylic acid, 6-bromo-8-[(4-methoxybenzoyl)amino]-4-oxo- [ACD/Index Name]
6-Brom-8-[(4-methoxybenzoyl)amino]-4-oxo-4H-chromen-2-carbonsäure [German] [ACD/IUPAC Name]
6-Bromo-8-[(4-methoxybenzoyl)amino]-4-oxo-4H-chromene-2-carboxylic acid [ACD/IUPAC Name]
Acide 6-bromo-8-[(4-méthoxybenzoyl)amino]-4-oxo-4H-chromène-2-carboxylique [French] [ACD/IUPAC Name]
1443367-20-1 [RN]
6-bromo-8-(4-methoxybenzamido)-4-oxo-4H-chromene-2-carboxylic acid
6-bromo-8-(4-methoxybenzamido)-4-oxochromene-2-carboxylic acid
MFCD32663466

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

Density: 1.7±0.1 g/cm3
Boiling Point: 508.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 261.5±30.1 °C
Index of Refraction: 1.696
Molar Refractivity: 94.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 72.7±3.0 dyne/cm
Molar Volume: 246.4±3.0 cm3

Click to predict properties on the Chemicalize site


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