ChemSpider 2D Image | 5-Bromo-1-chloro-6-methylisoquinoline | C10H7BrClN

5-Bromo-1-chloro-6-methylisoquinoline

  • Molecular FormulaC10H7BrClN
  • Average mass256.526 Da
  • Monoisotopic mass254.945038 Da
  • ChemSpider ID24597696

More details:

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

1245647-25-9 [RN]
5-Brom-1-chlor-6-methylisochinolin [German] [ACD/IUPAC Name]
5-Bromo-1-chloro-6-méthylisoquinoléine [French] [ACD/IUPAC Name]
5-Bromo-1-chloro-6-methylisoquinoline [ACD/IUPAC Name]
Isoquinoline, 5-bromo-1-chloro-6-methyl- [ACD/Index Name]
[1245647-25-9] [RN]
59290-82-3 [RN]
5-Bromo-1-chloro-6-methyl-isoquinoline
AGN-PC-07YNGK
AK-40482
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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: 1.6±0.1 g/cm3
    Boiling Point: 359.8±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 58.2±3.0 kJ/mol
    Flash Point: 171.4±26.5 °C
    Index of Refraction: 1.661
    Molar Refractivity: 59.6±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 3.86
    ACD/LogD (pH 5.5): 4.04
    ACD/BCF (pH 5.5): 696.34
    ACD/KOC (pH 5.5): 3771.20
    ACD/LogD (pH 7.4): 4.04
    ACD/BCF (pH 7.4): 696.41
    ACD/KOC (pH 7.4): 3771.58
    Polar Surface Area: 13 Å2
    Polarizability: 23.6±0.5 10-24cm3
    Surface Tension: 50.3±3.0 dyne/cm
    Molar Volume: 161.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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