ChemSpider 2D Image | 6,8-Dibromo-7-methoxy-3-(5-tetrazolidinyl)-2H-chromen-2-one | C11H10Br2N4O3

6,8-Dibromo-7-methoxy-3-(5-tetrazolidinyl)-2H-chromen-2-one

  • Molecular FormulaC11H10Br2N4O3
  • Average mass406.030 Da
  • Monoisotopic mass403.911957 Da
  • ChemSpider ID129180065

More details:

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

2H-1-Benzopyran-2-one, 6,8-dibromo-7-methoxy-3-(5-tetrazolidinyl)- [ACD/Index Name]
6,8-Dibrom-7-methoxy-3-(5-tetrazolidinyl)-2H-chromen-2-on [German] [ACD/IUPAC Name]
6,8-Dibromo-7-methoxy-3-(5-tetrazolidinyl)-2H-chromen-2-one [ACD/IUPAC Name]
6,8-Dibromo-7-méthoxy-3-(5-tétrazolidinyl)-2H-chromén-2-one [French] [ACD/IUPAC Name]

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

Density: 1.9±0.1 g/cm3
Boiling Point: 513.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 264.2±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 77.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 1.70
ACD/BCF (pH 5.5): 8.08
ACD/KOC (pH 5.5): 101.32
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 34.80
ACD/KOC (pH 7.4): 436.24
Polar Surface Area: 84 Å2
Polarizability: 30.9±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 218.0±3.0 cm3

Click to predict properties on the Chemicalize site


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