ChemSpider 2D Image | 6-BROMO-1H-PYRAZIN-2-ONE | C4H3BrN2O

6-BROMO-1H-PYRAZIN-2-ONE

  • Molecular FormulaC4H3BrN2O
  • Average mass174.983 Da
  • Monoisotopic mass173.942871 Da
  • ChemSpider ID27463642

More details:

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

2(1H)-Pyrazinone, 6-bromo- [ACD/Index Name]
6-Brom-2(1H)-pyrazinon [German] [ACD/IUPAC Name]
6-BROMO-1H-PYRAZIN-2-ONE
6-Bromo-2(1H)-pyrazinone [ACD/IUPAC Name]
6-Bromo-2(1H)-pyrazinone [French] [ACD/IUPAC Name]
859063-85-7 [RN]
2-Bromo-6-hydroxypyrazine
6-bromo-1,2-dihydropyrazin-2-one
6-Bromopyrazin-2(1H)-one
6-bromopyrazin-2-ol
More...

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

Density: 1.9±0.1 g/cm3
Boiling Point: 444.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.9±3.0 kJ/mol
Flash Point: 222.3±27.3 °C
Index of Refraction: 1.625
Molar Refractivity: 32.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 1.93
ACD/KOC (pH 5.5): 50.99
ACD/LogD (pH 7.4): -0.54
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.78
Polar Surface Area: 46 Å2
Polarizability: 12.7±0.5 10-24cm3
Surface Tension: 69.3±3.0 dyne/cm
Molar Volume: 90.5±3.0 cm3

Click to predict properties on the Chemicalize site


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