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Search term: BKACZLBGUSELFW (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 3,3,3-trifluoro-2-(1H-indol-3-yl)-2-[(3-methoxybenzoyl)amino]propanoate | C20H17F3N2O4

Methyl 3,3,3-trifluoro-2-(1H-indol-3-yl)-2-[(3-methoxybenzoyl)amino]propanoate

  • Molecular FormulaC20H17F3N2O4
  • Average mass406.355 Da
  • Monoisotopic mass406.114044 Da
  • ChemSpider ID29349865

More details:

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

1H-Indole-3-acetic acid, α-[(3-methoxybenzoyl)amino]-α-(trifluoromethyl)-, methyl ester [ACD/Index Name]
3,3,3-Trifluoro-2-(1H-indol-3-yl)-2-[(3-méthoxybenzoyl)amino]propanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 3,3,3-trifluoro-2-(1H-indol-3-yl)-2-[(3-methoxybenzoyl)amino]propanoate [ACD/IUPAC Name]
Methyl-3,3,3-trifluor-2-(1H-indol-3-yl)-2-[(3-methoxybenzoyl)amino]propanoat [German] [ACD/IUPAC Name]
1354769-06-4 [RN]
methyl 3,3,3-trifluoro-2-(1H-indol-3-yl)-2-(3-methoxybenzamido)propanoate
methyl 3,3,3-trifluoro-2-(1H-indol-3-yl)-2-{[(3-methoxyphenyl)carbonyl]amino}propanoate

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 578.8±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.6 mmHg at 25°C
    Enthalpy of Vaporization: 86.6±3.0 kJ/mol
    Flash Point: 303.8±30.1 °C
    Index of Refraction: 1.581
    Molar Refractivity: 99.0±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 2
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.86
    ACD/LogD (pH 5.5): 3.71
    ACD/BCF (pH 5.5): 389.02
    ACD/KOC (pH 5.5): 2486.03
    ACD/LogD (pH 7.4): 3.71
    ACD/BCF (pH 7.4): 389.00
    ACD/KOC (pH 7.4): 2485.93
    Polar Surface Area: 80 Å2
    Polarizability: 39.3±0.5 10-24cm3
    Surface Tension: 45.6±3.0 dyne/cm
    Molar Volume: 297.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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