ChemSpider 2D Image | Ethyl isoferulate | C12H14O4

Ethyl isoferulate

  • Molecular FormulaC12H14O4
  • Average mass222.237 Da
  • Monoisotopic mass222.089203 Da
  • ChemSpider ID19887945

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(3-Hydroxy-4-méthoxyphényl)acrylate d'éthyle [French] [ACD/IUPAC Name]
155401-23-3 [RN]
2-Propenoic acid, 3-(3-hydroxy-4-methoxyphenyl)-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-3-(3-hydroxy-4-methoxyphenyl)acrylate [ACD/IUPAC Name]
Ethyl isoferulate
Ethyl-(2E)-3-(3-hydroxy-4-methoxyphenyl)acrylat [German] [ACD/IUPAC Name]
(2E)-3-(3-hydroxy-4-methoxyphenyl)-2-propenoic acid ethyl ester
(E)-3-(3-Hydroxy-4-methoxyphenyl)-2-propenoic acid ethyl ester
(E)-Ethyl 3-(3-hydroxy-4-methoxyphenyl)acrylate
84428-15-9 [RN]
More...

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 380.7±32.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.4±3.0 kJ/mol
    Flash Point: 146.1±18.6 °C
    Index of Refraction: 1.566
    Molar Refractivity: 61.7±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.86
    ACD/LogD (pH 5.5): 2.16
    ACD/BCF (pH 5.5): 25.71
    ACD/KOC (pH 5.5): 355.55
    ACD/LogD (pH 7.4): 2.15
    ACD/BCF (pH 7.4): 25.49
    ACD/KOC (pH 7.4): 352.54
    Polar Surface Area: 56 Å2
    Polarizability: 24.5±0.5 10-24cm3
    Surface Tension: 43.5±3.0 dyne/cm
    Molar Volume: 189.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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