ChemSpider 2D Image | Ethyl 3-[4-(benzyloxy)-3,5-dimethoxyphenyl]-3-hydroxy-2-(2-methoxyphenoxy)propanoate | C27H30O8

Ethyl 3-[4-(benzyloxy)-3,5-dimethoxyphenyl]-3-hydroxy-2-(2-methoxyphenoxy)propanoate

  • Molecular FormulaC27H30O8
  • Average mass482.522 Da
  • Monoisotopic mass482.194061 Da
  • ChemSpider ID44253172

More details:

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

3-[4-(Benzyloxy)-3,5-diméthoxyphényl]-3-hydroxy-2-(2-méthoxyphénoxy)propanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-hydroxy-3,5-dimethoxy-α-(2-methoxyphenoxy)-4-(phenylmethoxy)-, ethyl ester [ACD/Index Name]
Ethyl 3-[4-(benzyloxy)-3,5-dimethoxyphenyl]-3-hydroxy-2-(2-methoxyphenoxy)propanoate [ACD/IUPAC Name]
Ethyl-3-[4-(benzyloxy)-3,5-dimethoxyphenyl]-3-hydroxy-2-(2-methoxyphenoxy)propanoat [German] [ACD/IUPAC Name]
151541-15-0 [RN]
DS-9475
Ethyl 3-(4-(benzyloxy)-3,5-dimethoxyphenyl)-3-hydroxy-2-(2-methoxyphenoxy)propanoate
ethyl3-(4-(benzyloxy)-3,5-dimethoxyphenyl)-3-hydroxy-2-(2-methoxyphenoxy)propanoate
MFCD28399423

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 641.4±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 99.5±3.0 kJ/mol
    Flash Point: 210.9±25.0 °C
    Index of Refraction: 1.567
    Molar Refractivity: 130.4±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 0
    ACD/LogP: 3.78
    ACD/LogD (pH 5.5): 3.53
    ACD/BCF (pH 5.5): 281.55
    ACD/KOC (pH 5.5): 1972.43
    ACD/LogD (pH 7.4): 3.53
    ACD/BCF (pH 7.4): 281.55
    ACD/KOC (pH 7.4): 1972.41
    Polar Surface Area: 93 Å2
    Polarizability: 51.7±0.5 10-24cm3
    Surface Tension: 44.7±3.0 dyne/cm
    Molar Volume: 399.0±3.0 cm3

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