ChemSpider 2D Image | 2-(3-Bromo-2,6-difluorobenzyl)-1H-isoindole-1,3(2H)-dione | C15H8BrF2NO2

2-(3-Bromo-2,6-difluorobenzyl)-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC15H8BrF2NO2
  • Average mass352.130 Da
  • Monoisotopic mass350.970642 Da
  • ChemSpider ID55044012

More details:






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

1H-Isoindole-1,3(2H)-dione, 2-[(3-bromo-2,6-difluorophenyl)methyl]- [ACD/Index Name]
2-(3-Brom-2,6-difluorbenzyl)-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]
2-(3-Bromo-2,6-difluorobenzyl)-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-(3-Bromo-2,6-difluorobenzyl)-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
1878385-75-1 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 431.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.8±3.0 kJ/mol
Flash Point: 215.0±28.7 °C
Index of Refraction: 1.645
Molar Refractivity: 74.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.09
ACD/LogD (pH 5.5): 4.02
ACD/BCF (pH 5.5): 672.82
ACD/KOC (pH 5.5): 3679.68
ACD/LogD (pH 7.4): 4.02
ACD/BCF (pH 7.4): 672.82
ACD/KOC (pH 7.4): 3679.68
Polar Surface Area: 37 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 58.7±3.0 dyne/cm
Molar Volume: 205.5±3.0 cm3

Click to predict properties on the Chemicalize site






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