Found 23 results

Search term: MF = 'C_{9}H_{6}IN'
ChemSpider 2D Image | 8-Iodoisoquinoline | C9H6IN

8-Iodoisoquinoline

  • Molecular FormulaC9H6IN
  • Average mass255.055 Da
  • Monoisotopic mass254.954483 Da
  • ChemSpider ID28599655

More details:

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

1131605-27-0 [RN]
8-Iodisochinolin [German] [ACD/IUPAC Name]
8-Iodoisoquinoléine [French] [ACD/IUPAC Name]
8-Iodoisoquinoline [ACD/IUPAC Name]
Isoquinoline, 8-iodo- [ACD/Index Name]
MFCD11865312

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

    Density: 1.8±0.1 g/cm3
    Boiling Point: 336.8±15.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.7±3.0 kJ/mol
    Flash Point: 157.5±20.4 °C
    Index of Refraction: 1.724
    Molar Refractivity: 55.1±0.3 cm3
    #H bond acceptors: 1
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 2.99
    ACD/LogD (pH 5.5): 2.96
    ACD/BCF (pH 5.5): 100.72
    ACD/KOC (pH 5.5): 909.43
    ACD/LogD (pH 7.4): 3.02
    ACD/BCF (pH 7.4): 115.09
    ACD/KOC (pH 7.4): 1039.12
    Polar Surface Area: 13 Å2
    Polarizability: 21.8±0.5 10-24cm3
    Surface Tension: 56.6±3.0 dyne/cm
    Molar Volume: 138.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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