ChemSpider 2D Image | ({(2Z)-2-[(6-Chloro-4H-1,3-benzodioxin-8-yl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile | C19H12ClNO5

({(2Z)-2-[(6-Chloro-4H-1,3-benzodioxin-8-yl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile

  • Molecular FormulaC19H12ClNO5
  • Average mass369.755 Da
  • Monoisotopic mass369.040405 Da
  • ChemSpider ID22883373

  • Double-bond stereo - Double-bond stereo

More details:

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

({(2Z)-2-[(6-Chlor-4H-1,3-benzodioxin-8-yl)methylen]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitril [German] [ACD/IUPAC Name]
({(2Z)-2-[(6-Chloro-4H-1,3-benzodioxin-8-yl)methylene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile [ACD/IUPAC Name]
({(2Z)-2-[(6-Chloro-4H-1,3-benzodioxin-8-yl)méthylène]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acétonitrile [French] [ACD/IUPAC Name]
Acetonitrile, 2-[[(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylene]-2,3-dihydro-3-oxo-6-benzofuranyl]oxy]- [ACD/Index Name]
({(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-2,3-dihydro-1-benzofuran-6-yl}oxy)acetonitrile
2-[[(2Z)-2-[(6-chloro-4H-1,3-benzodioxin-8-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxy]acetonitrile
929811-66-5 [RN]
AKOS022133680
MolPort-005-913-531
STL350460
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 655.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.5±3.0 kJ/mol
    Flash Point: 350.2±31.5 °C
    Index of Refraction: 1.672
    Molar Refractivity: 93.1±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.03
    ACD/LogD (pH 5.5): 3.14
    ACD/BCF (pH 5.5): 144.55
    ACD/KOC (pH 5.5): 1223.89
    ACD/LogD (pH 7.4): 3.14
    ACD/BCF (pH 7.4): 144.55
    ACD/KOC (pH 7.4): 1223.89
    Polar Surface Area: 78 Å2
    Polarizability: 36.9±0.5 10-24cm3
    Surface Tension: 66.0±3.0 dyne/cm
    Molar Volume: 248.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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