ChemSpider 2D Image | 1,3-Benzodioxol-5-ylmalonic acid | C10H8O6

1,3-Benzodioxol-5-ylmalonic acid

  • Molecular FormulaC10H8O6
  • Average mass224.167 Da
  • Monoisotopic mass224.032089 Da
  • ChemSpider ID26264556

More details:

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

1,3-Benzodioxol-5-ylmalonic acid [ACD/IUPAC Name]
1,3-Benzodioxol-5-ylmalonsäure [German] [ACD/IUPAC Name]
Acide 1,3-benzodioxol-5-ylmalonique [French] [ACD/IUPAC Name]
Propanedioic acid, 2-(1,3-benzodioxol-5-yl)- [ACD/Index Name]
2-(1,3-BENZODIOXOL-5-YL)-PROPANEDIOIC ACID
683220-09-9 [RN]
MFCD03412540

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

Density: 1.6±0.1 g/cm3
Boiling Point: 439.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 180.2±22.2 °C
Index of Refraction: 1.629
Molar Refractivity: 49.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): -2.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.49
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 93 Å2
Polarizability: 19.7±0.5 10-24cm3
Surface Tension: 82.1±3.0 dyne/cm
Molar Volume: 139.9±3.0 cm3

Click to predict properties on the Chemicalize site


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