ChemSpider 2D Image | 1,4-Dibromo-2-isocyanatobenzene | C7H3Br2NO

1,4-Dibromo-2-isocyanatobenzene

  • Molecular FormulaC7H3Br2NO
  • Average mass276.913 Da
  • Monoisotopic mass274.858124 Da
  • ChemSpider ID40206912

More details:

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

1,4-Dibrom-2-isocyanatobenzol [German] [ACD/IUPAC Name]
1,4-Dibromo-2-isocyanatobenzene [ACD/IUPAC Name]
1,4-Dibromo-2-isocyanatobenzène [French] [ACD/IUPAC Name]
55076-91-0 [RN]
Benzene, 1,4-dibromo-2-isocyanato- [ACD/Index Name]
MFCD18269835

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

Density: 1.9±0.1 g/cm3
Boiling Point: 298.1±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 53.8±3.0 kJ/mol
Flash Point: 134.1±24.6 °C
Index of Refraction: 1.632
Molar Refractivity: 51.3±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.22
ACD/LogD (pH 5.5): 3.95
ACD/BCF (pH 5.5): 587.32
ACD/KOC (pH 5.5): 3338.58
ACD/LogD (pH 7.4): 3.95
ACD/BCF (pH 7.4): 587.32
ACD/KOC (pH 7.4): 3338.58
Polar Surface Area: 29 Å2
Polarizability: 20.3±0.5 10-24cm3
Surface Tension: 50.1±7.0 dyne/cm
Molar Volume: 143.7±7.0 cm3

Click to predict properties on the Chemicalize site


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