ChemSpider 2D Image | 7-Bromo Epinastine | C16H14BrN3

7-Bromo Epinastine

  • Molecular FormulaC16H14BrN3
  • Average mass328.207 Da
  • Monoisotopic mass327.037109 Da
  • ChemSpider ID30782968

More details:

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

1217052-16-8 [RN]
1H-Dibenz[c,f]imidazo[1,5-a]azepin-3-amine, 7-bromo-9,13b-dihydro- [ACD/Index Name]
7-Brom-9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amin [German] [ACD/IUPAC Name]
7-Bromo Epinastine
7-Bromo Epinastine HBr
7-Bromo-9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3-amine [ACD/IUPAC Name]
7-Bromo-9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azépin-3-amine [French] [ACD/IUPAC Name]
[1217052-16-8] [RN]
7-bromo-9,13b-dihydro-1H-dibenzo[c,f]imidazo[1,5-a]azepin-3(2H)-imine
MFCD21363590

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

0UEF411R2M [DBID]
UNII:0UEF411R2M [DBID]

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 484.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.0±3.0 kJ/mol
    Flash Point: 246.8±31.5 °C
    Index of Refraction: 1.758
    Molar Refractivity: 82.6±0.5 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 4.45
    ACD/LogD (pH 5.5): 1.61
    ACD/BCF (pH 5.5): 3.25
    ACD/KOC (pH 5.5): 21.84
    ACD/LogD (pH 7.4): 1.61
    ACD/BCF (pH 7.4): 3.27
    ACD/KOC (pH 7.4): 21.98
    Polar Surface Area: 42 Å2
    Polarizability: 32.7±0.5 10-24cm3
    Surface Tension: 59.2±7.0 dyne/cm
    Molar Volume: 201.0±7.0 cm3

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