ChemSpider 2D Image | Ethyl (2,3,4-trimethoxy-6-octanoylphenyl)acetate | C21H32O6

Ethyl (2,3,4-trimethoxy-6-octanoylphenyl)acetate

  • Molecular FormulaC21H32O6
  • Average mass380.475 Da
  • Monoisotopic mass380.219879 Da
  • ChemSpider ID28290377

More details:

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

(2,3,4-Triméthoxy-6-octanoylphényl)acétate d'éthyle [French] [ACD/IUPAC Name]
1258275-73-8 [RN]
Benzeneacetic acid, 2,3,4-trimethoxy-6-(1-oxooctyl)-, ethyl ester [ACD/Index Name]
Ethyl (2,3,4-trimethoxy-6-octanoylphenyl)acetate [ACD/IUPAC Name]
Ethyl 2-(2,3,4-trimethoxy-6-octanoylphenyl)acetate
Ethyl-(2,3,4-trimethoxy-6-octanoylphenyl)acetat [German] [ACD/IUPAC Name]
ethyl 2-[2,3,4-trimethoxy-6-(1-octanoyl)phenyl]acetate
TMPA
TMY

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 480.0±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.4±3.0 kJ/mol
    Flash Point: 205.8±28.8 °C
    Index of Refraction: 1.491
    Molar Refractivity: 104.7±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 14
    #Rule of 5 Violations: 1
    ACD/LogP: 5.25
    ACD/LogD (pH 5.5): 5.28
    ACD/BCF (pH 5.5): 6049.19
    ACD/KOC (pH 5.5): 17722.72
    ACD/LogD (pH 7.4): 5.28
    ACD/BCF (pH 7.4): 6049.19
    ACD/KOC (pH 7.4): 17722.72
    Polar Surface Area: 71 Å2
    Polarizability: 41.5±0.5 10-24cm3
    Surface Tension: 35.5±3.0 dyne/cm
    Molar Volume: 361.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement