ChemSpider 2D Image | 2,5-Dimethoxybenzyl 3-methylbutanoate | C14H20O4

2,5-Dimethoxybenzyl 3-methylbutanoate

  • Molecular FormulaC14H20O4
  • Average mass252.306 Da
  • Monoisotopic mass252.136154 Da
  • ChemSpider ID28535075

More details:

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

2,5-Dimethoxybenzyl 3-methylbutanoate [ACD/IUPAC Name]
2,5-Dimethoxybenzyl-3-methylbutanoat [German] [ACD/IUPAC Name]
3-Méthylbutanoate de 2,5-diméthoxybenzyle [French] [ACD/IUPAC Name]
Butanoic acid, 3-methyl-, (2,5-dimethoxyphenyl)methyl ester [ACD/Index Name]
(2,5-Dimethoxyphenyl)methyl 3-methylbutanoate
[876665-00-8] [RN]
2,5-Dimethoxybenzyl3-methylbutanoate
2,5-DIMETHOXYBENZYL-3-METHYLBUTANOATE
876665-00-8 [RN]
MFCD23135509

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 333.1±27.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.6±3.0 kJ/mol
    Flash Point: 143.1±23.8 °C
    Index of Refraction: 1.490
    Molar Refractivity: 69.4±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 3.22
    ACD/LogD (pH 5.5): 2.78
    ACD/BCF (pH 5.5): 76.79
    ACD/KOC (pH 5.5): 778.20
    ACD/LogD (pH 7.4): 2.78
    ACD/BCF (pH 7.4): 76.79
    ACD/KOC (pH 7.4): 778.20
    Polar Surface Area: 45 Å2
    Polarizability: 27.5±0.5 10-24cm3
    Surface Tension: 33.7±3.0 dyne/cm
    Molar Volume: 240.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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