ChemSpider 2D Image | 5,8-Dichloro-7-nitroisoquinoline | C9H4Cl2N2O2

5,8-Dichloro-7-nitroisoquinoline

  • Molecular FormulaC9H4Cl2N2O2
  • Average mass243.046 Da
  • Monoisotopic mass241.964981 Da
  • ChemSpider ID26052617

More details:

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

1198775-29-9 [RN]
5,8-Dichlor-7-nitroisochinolin [German] [ACD/IUPAC Name]
5,8-Dichloro-7-nitroisoquinoléine [French] [ACD/IUPAC Name]
5,8-Dichloro-7-nitroisoquinoline [ACD/IUPAC Name]
Isoquinoline, 5,8-dichloro-7-nitro- [ACD/Index Name]
T66 CNJ GG INW JG [WLN]
95%
dichloronitroisoquinoline
EE-0006

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

    Density: 1.6±0.1 g/cm3
    Boiling Point: 399.3±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.5±3.0 kJ/mol
    Flash Point: 195.3±26.5 °C
    Index of Refraction: 1.693
    Molar Refractivity: 58.5±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 2.69
    ACD/LogD (pH 5.5): 3.09
    ACD/BCF (pH 5.5): 132.10
    ACD/KOC (pH 5.5): 1147.44
    ACD/LogD (pH 7.4): 3.09
    ACD/BCF (pH 7.4): 132.14
    ACD/KOC (pH 7.4): 1147.72
    Polar Surface Area: 59 Å2
    Polarizability: 23.2±0.5 10-24cm3
    Surface Tension: 64.7±3.0 dyne/cm
    Molar Volume: 152.5±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement