ChemSpider 2D Image | 5-Hydroxy-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]tryptophan | C29H28N2O7

5-Hydroxy-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]tryptophan

  • Molecular FormulaC29H28N2O7
  • Average mass516.542 Da
  • Monoisotopic mass516.189636 Da
  • ChemSpider ID4020035

More details:

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

5-Hydroxy-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]tryptophan [ACD/IUPAC Name]
5-Hydroxy-N-[3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]tryptophan [German] [ACD/IUPAC Name]
5-Hydroxy-N-[3-(2,3,5,9-tétraméthyl-7-oxo-7H-furo[3,2-g]chromén-6-yl)propanoyl]tryptophane [French] [ACD/IUPAC Name]
Tryptophan, 5-hydroxy-N-[1-oxo-3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g][1]benzopyran-6-yl)propyl]- [ACD/Index Name]
1214125-84-4 [RN]
3-(5-hydroxy-1H-indol-3-yl)-2-(3-(2,3,5,9-tetramethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanamido)propanoic acid
3-(5-hydroxy-1H-indol-3-yl)-2-[3-(2,3,5,9-tetramethyl-7-oxofuro[3,2-g]chromen-6-yl)propanoylamino]propanoic 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: 873.3±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 133.0±3.0 kJ/mol
    Flash Point: 482.0±34.3 °C
    Index of Refraction: 1.674
    Molar Refractivity: 140.7±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 4
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 4.17
    ACD/LogD (pH 5.5): 1.53
    ACD/BCF (pH 5.5): 2.32
    ACD/KOC (pH 5.5): 13.45
    ACD/LogD (pH 7.4): 0.26
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 142 Å2
    Polarizability: 55.8±0.5 10-24cm3
    Surface Tension: 64.5±3.0 dyne/cm
    Molar Volume: 374.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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