ChemSpider 2D Image | 4-Hydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate | C20H22O6

4-Hydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate

  • Molecular FormulaC20H22O6
  • Average mass358.385 Da
  • Monoisotopic mass358.141632 Da
  • ChemSpider ID78435861

More details:

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

2,4-Dihydroxy-6-méthylbenzoate de 4-hydroxy-3-méthoxy-2-(3-méthyl-2-butén-1-yl)phényle [French] [ACD/IUPAC Name]
4-Hydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate [ACD/IUPAC Name]
4-Hydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)phenyl-2,4-dihydroxy-6-methylbenzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2,4-dihydroxy-6-methyl-, 4-hydroxy-3-methoxy-2-(3-methyl-2-buten-1-yl)phenyl ester [ACD/Index Name]
4-hydroxy-3-methoxy-2-(3-methylbut-2-en-1-yl)phenyl 2,4-dihydroxy-6-methylbenzoate

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

Density: 1.3±0.1 g/cm3
Boiling Point: 587.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.0±3.0 kJ/mol
Flash Point: 208.7±23.6 °C
Index of Refraction: 1.609
Molar Refractivity: 98.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.02
ACD/LogD (pH 5.5): 4.74
ACD/BCF (pH 5.5): 2364.81
ACD/KOC (pH 5.5): 9008.29
ACD/LogD (pH 7.4): 4.39
ACD/BCF (pH 7.4): 1046.66
ACD/KOC (pH 7.4): 3987.05
Polar Surface Area: 96 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 284.2±3.0 cm3

Click to predict properties on the Chemicalize site


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