ChemSpider 2D Image | 3,4-Dihydro-2H-1,5-benzodioxepine-2,4-dicarboxylic acid | C11H10O6

3,4-Dihydro-2H-1,5-benzodioxepine-2,4-dicarboxylic acid

  • Molecular FormulaC11H10O6
  • Average mass238.193 Da
  • Monoisotopic mass238.047745 Da
  • ChemSpider ID24218267

More details:

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

2H-1,5-Benzodioxepin-2,4-dicarboxylic acid, 3,4-dihydro- [ACD/Index Name]
3,4-Dihydro-2H-1,5-benzodioxepin-2,4-dicarbonsäure [German] [ACD/IUPAC Name]
3,4-Dihydro-2H-1,5-benzodioxepine-2,4-dicarboxylic acid [ACD/IUPAC Name]
Acide 3,4-dihydro-2H-1,5-benzodioxépine-2,4-dicarboxylique [French] [ACD/IUPAC Name]
2H-1,5-BENZODIOXEPIN-2,4-DICARBOXYLIC ACID 3,4-DIHYDRO-
2H-1,5-Benzodioxepin-2,4-dicarboxylic acid, 3,4-dihydro- (9CI)
49833-08-1 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 441.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 177.0±22.2 °C
Index of Refraction: 1.585
Molar Refractivity: 53.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.79
ACD/LogD (pH 5.5): -3.81
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.99
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 63.7±3.0 dyne/cm
Molar Volume: 160.6±3.0 cm3

Click to predict properties on the Chemicalize site


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