ChemSpider 2D Image | Methyl 4-hydroxy-3,5-bis[(~2~H_3_)methyloxy]benzoate | C10H6D6O5

Methyl 4-hydroxy-3,5-bis[(2H3)methyloxy]benzoate

  • Molecular FormulaC10H6D6O5
  • Average mass218.236 Da
  • Monoisotopic mass218.106140 Da
  • ChemSpider ID34559515

  • Non-standard isotope - Non-standard isotope

More details:

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

4-Hydroxy-3,5-bis[(2H3)méthyloxy]benzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-hydroxy-3,5-bis(methyl-d3-oxy)-, methyl ester [ACD/Index Name]
Methyl 4-hydroxy-3,5-bis[(2H3)methyloxy]benzoate [ACD/IUPAC Name]
Methyl-4-hydroxy-3,5-bis[(2H3)methyloxy]benzoat [German] [ACD/IUPAC Name]
1182838-09-0 [RN]
Methyl 4-hydroxy-3,5-dimethoxy-d6-benzoate
Methyl 4-hydroxy-3,5-dimethoxy-d6-benzoate

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

Density: 1.2±0.1 g/cm3
Boiling Point: 339.9±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.6±3.0 kJ/mol
Flash Point: 132.4±20.0 °C
Index of Refraction: 1.525
Molar Refractivity: 53.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.10
ACD/LogD (pH 5.5): 1.43
ACD/BCF (pH 5.5): 7.16
ACD/KOC (pH 5.5): 142.43
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 6.49
ACD/KOC (pH 7.4): 129.12
Polar Surface Area: 65 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 41.3±3.0 dyne/cm
Molar Volume: 173.8±3.0 cm3

Click to predict properties on the Chemicalize site


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