ChemSpider 2D Image | 1,3-Dibromo-5-isocyanatobenzene | C7H3Br2NO

1,3-Dibromo-5-isocyanatobenzene

  • Molecular FormulaC7H3Br2NO
  • Average mass276.913 Da
  • Monoisotopic mass274.858124 Da
  • ChemSpider ID15289618

More details:

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

1,3-Dibrom-5-isocyanatobenzol [German] [ACD/IUPAC Name]
1,3-Dibromo-5-isocyanatobenzene [ACD/IUPAC Name]
1,3-Dibromo-5-isocyanatobenzène [French] [ACD/IUPAC Name]
35122-97-5 [RN]
Benzene, 1,3-dibromo-5-isocyanato- [ACD/Index Name]
3,5-dibromo-phenyl isocyanate
MFCD18390598

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

    Density: 1.9±0.0 g/cm3
    Boiling Point: 302.6±0.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.0 mmHg at 25°C
    Enthalpy of Vaporization: 54.3±0.0 kJ/mol
    Flash Point: 136.8±0.0 °C
    Index of Refraction: 1.632
    Molar Refractivity: 51.3±0.0 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 4.32
    ACD/LogD (pH 5.5): 4.32
    ACD/BCF (pH 5.5): 1128.26
    ACD/KOC (pH 5.5): 5327.38
    ACD/LogD (pH 7.4): 4.32
    ACD/BCF (pH 7.4): 1128.26
    ACD/KOC (pH 7.4): 5327.38
    Polar Surface Area: 29 Å2
    Polarizability: 20.3±0.0 10-24cm3
    Surface Tension: 50.1±0.0 dyne/cm
    Molar Volume: 143.7±0.0 cm3

    Click to predict properties on the Chemicalize site


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