ChemSpider 2D Image | N-(5-Bromo-3-pyridinyl)benzenesulfonamide | C11H9BrN2O2S

N-(5-Bromo-3-pyridinyl)benzenesulfonamide

  • Molecular FormulaC11H9BrN2O2S
  • Average mass313.170 Da
  • Monoisotopic mass311.956818 Da
  • ChemSpider ID26517950

More details:

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

1084-12-4 [RN]
Benzenesulfonamide, N-(5-bromo-3-pyridinyl)- [ACD/Index Name]
N-(5-Brom-3-pyridinyl)benzolsulfonamid [German] [ACD/IUPAC Name]
N-(5-Bromo-3-pyridinyl)benzenesulfonamide [ACD/IUPAC Name]
N-(5-Bromo-3-pyridinyl)benzènesulfonamide [French] [ACD/IUPAC Name]
N-(5-bromopyridin-3-yl)benzenesulfonamide
(1S,2R,E)-1-(3,5-di-tert-butyl-2-hydroxybenzylideneamino)-2,3-dihydro-1H-inden-2-ol
5-Bromo-3-(phenylsulfonamido)pyridine
atoms 17 bonds 18
MFCD17169878 [MDL number]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 433.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.9±3.0 kJ/mol
Flash Point: 215.9±31.5 °C
Index of Refraction: 1.661
Molar Refractivity: 69.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.50
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 63.95
ACD/KOC (pH 5.5): 660.78
ACD/LogD (pH 7.4): 1.77
ACD/BCF (pH 7.4): 7.58
ACD/KOC (pH 7.4): 78.36
Polar Surface Area: 67 Å2
Polarizability: 27.5±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 188.0±3.0 cm3

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