Found 4 results

Search term: JNDVEAXZWJIOKB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-{4-Methyl-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl}propanoic acid | C17H16N2O3

3-{4-Methyl-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl}propanoic acid

  • Molecular FormulaC17H16N2O3
  • Average mass296.320 Da
  • Monoisotopic mass296.116089 Da
  • ChemSpider ID11438307

  • Double-bond stereo - Double-bond stereo

More details:

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

1H-Pyrrole-3-propanoic acid, 2-[(E)-(1,2-dihydro-2-oxo-3H-indol-3-ylidene)methyl]-4-methyl- [ACD/Index Name]
3-{4-Methyl-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-yliden)methyl]-1H-pyrrol-3-yl}propansäure [German] [ACD/IUPAC Name]
3-{4-Methyl-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl}propanoic acid [ACD/IUPAC Name]
Acide 3-{4-méthyl-2-[(E)-(2-oxo-1,2-dihydro-3H-indol-3-ylidène)méthyl]-1H-pyrrol-3-yl}propanoïque [French] [ACD/IUPAC Name]
(E)-3-(4-methyl-2-((2-oxoindolin-3-ylidene)methyl)-1H-pyrrol-3-yl)propanoic acid
2-[(1,2-Dihydro-2-oxo-3H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrole-3-propanoic acid
215543-92-3 [RN]
3-(4-METHYL-2-{[(3E)-2-OXO-1H-INDOL-3-YLIDENE]METHYL}-1H-PYRROL-3-YL)PROPANOIC ACID
3-[4-methyl-2-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid
SU 5402
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 592.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.9±3.0 kJ/mol
    Flash Point: 312.2±30.1 °C
    Index of Refraction: 1.688
    Molar Refractivity: 82.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.03
    ACD/LogD (pH 5.5): 1.75
    ACD/BCF (pH 5.5): 7.82
    ACD/KOC (pH 5.5): 86.43
    ACD/LogD (pH 7.4): -0.05
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.37
    Polar Surface Area: 82 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 67.9±3.0 dyne/cm
    Molar Volume: 217.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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