ChemSpider 2D Image | 1,3-Dichloro-7-methoxyisoquinoline | C10H7Cl2NO

1,3-Dichloro-7-methoxyisoquinoline

  • Molecular FormulaC10H7Cl2NO
  • Average mass228.075 Da
  • Monoisotopic mass226.990463 Da
  • ChemSpider ID28638188

More details:

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

1,3-Dichlor-7-methoxyisochinolin [German] [ACD/IUPAC Name]
1,3-Dichloro-7-méthoxyisoquinoléine [French] [ACD/IUPAC Name]
1,3-Dichloro-7-methoxyisoquinoline [ACD/IUPAC Name]
24623-40-3 [RN]
Isoquinoline, 1,3-dichloro-7-methoxy- [ACD/Index Name]
1,3-Dichloro-7-methoxy-isoquinoline
AGN-PC-0JJ1LI
AH-0722
MFCD20441180 [MDL number]
MolPort-020-249-886
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 367.2±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 59.0±3.0 kJ/mol
    Flash Point: 175.9±26.5 °C
    Index of Refraction: 1.631
    Molar Refractivity: 58.7±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 3.20
    ACD/LogD (pH 5.5): 3.35
    ACD/BCF (pH 5.5): 208.44
    ACD/KOC (pH 5.5): 1590.50
    ACD/LogD (pH 7.4): 3.35
    ACD/BCF (pH 7.4): 208.44
    ACD/KOC (pH 7.4): 1590.50
    Polar Surface Area: 22 Å2
    Polarizability: 23.3±0.5 10-24cm3
    Surface Tension: 48.1±3.0 dyne/cm
    Molar Volume: 164.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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