ChemSpider 2D Image | (3-{[(4,5-Dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetyl]amino}phenoxy)acetic acid | C20H19NO8

(3-{[(4,5-Dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetyl]amino}phenoxy)acetic acid

  • Molecular FormulaC20H19NO8
  • Average mass401.367 Da
  • Monoisotopic mass401.111053 Da
  • ChemSpider ID32514678

More details:

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

(3-{[(4,5-Dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetyl]amino}phenoxy)acetic acid [ACD/IUPAC Name]
(3-{[(4,5-Dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acetyl]amino}phenoxy)essigsäure [German] [ACD/IUPAC Name]
Acetic acid, 2-[3-[[2-(1,3-dihydro-4,5-dimethoxy-3-oxo-1-isobenzofuranyl)acetyl]amino]phenoxy]- [ACD/Index Name]
Acide (3-{[2-(4,5-diméthoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)acétyl]amino}phénoxy)acétique [French] [ACD/IUPAC Name]
1630858-12-6 [RN]
2-(3-(2-(4,5-dimethoxy-3-oxo-1,3-dihydroisobenzofuran-1-yl)acetamido)phenoxy)acetic acid

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 715.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 109.7±3.0 kJ/mol
    Flash Point: 386.2±32.9 °C
    Index of Refraction: 1.614
    Molar Refractivity: 100.3±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 0.92
    ACD/LogD (pH 5.5): -0.70
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.00
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 120 Å2
    Polarizability: 39.8±0.5 10-24cm3
    Surface Tension: 60.2±3.0 dyne/cm
    Molar Volume: 287.7±3.0 cm3

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