ChemSpider 2D Image | Isopropyl 4-hydroxy-3,5-dimethoxybenzoate | C12H16O5

Isopropyl 4-hydroxy-3,5-dimethoxybenzoate

  • Molecular FormulaC12H16O5
  • Average mass240.252 Da
  • Monoisotopic mass240.099777 Da
  • ChemSpider ID28554578

More details:

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

1-Methylethyl 4-hydroxy-3,5-dimethoxybenzoate
4-Hydroxy-3,5-diméthoxybenzoate d'isopropyle [French] [ACD/IUPAC Name]
858131-80-3 [RN]
Benzoic acid, 4-hydroxy-3,5-dimethoxy-, 1-methylethyl ester [ACD/Index Name]
Isopropyl 4-hydroxy-3,5-dimethoxybenzoate [ACD/IUPAC Name]
Isopropyl-4-hydroxy-3,5-dimethoxybenzoat [German] [ACD/IUPAC Name]
[858131-80-3] [RN]
594-44-5 [RN]
AGN-PC-0JHFST
AK-85820
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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: 359.0±37.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 62.8±3.0 kJ/mol
    Flash Point: 133.3±20.0 °C
    Index of Refraction: 1.515
    Molar Refractivity: 62.5±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.98
    ACD/LogD (pH 5.5): 2.00
    ACD/BCF (pH 5.5): 19.35
    ACD/KOC (pH 5.5): 290.03
    ACD/LogD (pH 7.4): 1.96
    ACD/BCF (pH 7.4): 17.80
    ACD/KOC (pH 7.4): 266.85
    Polar Surface Area: 65 Å2
    Polarizability: 24.8±0.5 10-24cm3
    Surface Tension: 38.9±3.0 dyne/cm
    Molar Volume: 207.2±3.0 cm3

    Click to predict properties on the Chemicalize site


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