ChemSpider 2D Image | 3,5-Dimethoxy-O-methyltyrosine | C12H17NO5

3,5-Dimethoxy-O-methyltyrosine

  • Molecular FormulaC12H17NO5
  • Average mass255.267 Da
  • Monoisotopic mass255.110672 Da
  • ChemSpider ID32819138

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(S)-2-AMINO-3-(3,4,5-TRIMETHOXY-PHENYL)-PROPIONIC ACID
18652-97-6 [RN]
3,5-Dimethoxy-O-methyl-L-tyrosin [German] [ACD/IUPAC Name]
3,5-Dimethoxy-O-methyl-L-tyrosine [ACD/IUPAC Name]
3,5-Diméthoxy-O-méthyl-L-tyrosine [French] [ACD/IUPAC Name]
3,5-Dimethoxy-O-methyltyrosin [German] [ACD/IUPAC Name]
3,5-Dimethoxy-O-methyltyrosine [ACD/IUPAC Name]
3,5-Diméthoxy-O-méthyltyrosine [French] [ACD/IUPAC Name]
L-Tyrosine, 3,5-dimethoxy-O-methyl- [ACD/Index Name]
Tyrosine, 3,5-dimethoxy-O-methyl- [ACD/Index Name]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 401.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 68.8±3.0 kJ/mol
    Flash Point: 196.8±28.7 °C
    Index of Refraction: 1.538
    Molar Refractivity: 65.5±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 0.55
    ACD/LogD (pH 5.5): -2.06
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.09
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 91 Å2
    Polarizability: 26.0±0.5 10-24cm3
    Surface Tension: 44.8±3.0 dyne/cm
    Molar Volume: 209.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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