ChemSpider 2D Image | Methoxymethyl 3,4,5-trihydroxybenzoate | C9H10O6

Methoxymethyl 3,4,5-trihydroxybenzoate

  • Molecular FormulaC9H10O6
  • Average mass214.172 Da
  • Monoisotopic mass214.047745 Da
  • ChemSpider ID28557298

More details:

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

194229-36-2 [RN]
3,4,5-Trihydroxybenzoate de méthoxyméthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3,4,5-trihydroxy-, methoxymethyl ester [ACD/Index Name]
Methoxymethyl 3,4,5-trihydroxybenzoate [ACD/IUPAC Name]
Methoxymethyl-3,4,5-trihydroxybenzoat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 472.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.4±3.0 kJ/mol
Flash Point: 194.1±22.2 °C
Index of Refraction: 1.604
Molar Refractivity: 50.0±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.38
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 3.99
ACD/KOC (pH 5.5): 93.52
ACD/LogD (pH 7.4): 0.88
ACD/BCF (pH 7.4): 2.46
ACD/KOC (pH 7.4): 57.67
Polar Surface Area: 96 Å2
Polarizability: 19.8±0.5 10-24cm3
Surface Tension: 67.2±3.0 dyne/cm
Molar Volume: 145.5±3.0 cm3

Click to predict properties on the Chemicalize site


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