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Search term: 119736-21-9 (Found by approved synonym)
ChemSpider 2D Image | 2-Bromisonicotinsäure-1-oxid | C6H4BrNO3

2-Bromisonicotinsäure-1-oxid

  • Molecular FormulaC6H4BrNO3
  • Average mass218.005 Da
  • Monoisotopic mass216.937454 Da
  • ChemSpider ID21428927

More details:

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

119736-21-9 [RN]
2-Bromisonicotinsäure-1-oxid
2-Bromisonicotinsäure-1-oxid [German] [ACD/IUPAC Name]
2-Bromo-4-pyridinecarboxylic acid-1-oxide
2-Bromoisonicotinic acid 1-oxide [ACD/IUPAC Name]
4-Pyridinecarboxylic acid, 2-bromo-, 1-oxide [ACD/Index Name]
Acide 1-oxyde de 2-bromoisonicotinique [French] [ACD/IUPAC Name]
Acide 2-bromoisonicotinique-1-oxyde
2-Bromo-1-oxo-1λ5-pyridine-4-carboxylic acid
2-bromo-4-carboxypyridin-1-ium-1-olate

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

Density: 1.9±0.1 g/cm3
Boiling Point: 507.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 260.5±25.9 °C
Index of Refraction: 1.640
Molar Refractivity: 41.7±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: -0.71
ACD/LogD (pH 5.5): -2.86
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.35
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 16.5±0.5 10-24cm3
Surface Tension: 62.9±7.0 dyne/cm
Molar Volume: 115.7±7.0 cm3

Click to predict properties on the Chemicalize site


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