ChemSpider 2D Image | Methyl 2,3-dioxo-2,3-dihydro-1,4-benzodioxine-6-carboxylate | C10H6O6

Methyl 2,3-dioxo-2,3-dihydro-1,4-benzodioxine-6-carboxylate

  • Molecular FormulaC10H6O6
  • Average mass222.151 Da
  • Monoisotopic mass222.016434 Da
  • ChemSpider ID28605210

More details:

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

1,4-Benzodioxin-6-carboxylic acid, 2,3-dihydro-2,3-dioxo-, methyl ester [ACD/Index Name]
2,3-Dioxo-2,3-dihydro-1,4-benzodioxine-6-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2,3-dioxo-2,3-dihydro-1,4-benzodioxine-6-carboxylate [ACD/IUPAC Name]
Methyl-2,3-dioxo-2,3-dihydro-1,4-benzodioxin-6-carboxylat [German] [ACD/IUPAC Name]
2,3-Dihydro-2,3-dioxo-1,4-benzodioxin-6-carboxylic acid methyl ester
97005-07-7 [RN]
MFCD24842643 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 368.3±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.5±3.0 kJ/mol
Flash Point: 167.0±28.5 °C
Index of Refraction: 1.571
Molar Refractivity: 49.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.46
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 7.50
ACD/KOC (pH 5.5): 147.23
ACD/LogD (pH 7.4): 1.45
ACD/BCF (pH 7.4): 7.50
ACD/KOC (pH 7.4): 147.23
Polar Surface Area: 79 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 55.5±3.0 dyne/cm
Molar Volume: 149.2±3.0 cm3

Click to predict properties on the Chemicalize site


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