ChemSpider 2D Image | (4,5,6,7-~2~H_4_)-1,3-Benzodioxole | C7H2D4O2

(4,5,6,7-2H4)-1,3-Benzodioxole

  • Molecular FormulaC7H2D4O2
  • Average mass126.146 Da
  • Monoisotopic mass126.061890 Da
  • ChemSpider ID107437258

  • Non-standard isotope - Non-standard isotope

More details:

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

(4,5,6,7-2H4)-1,3-Benzodioxol [German] [ACD/IUPAC Name]
(4,5,6,7-2H4)-1,3-Benzodioxole [ACD/IUPAC Name]
(4,5,6,7-2H4)-1,3-Benzodioxole [French] [ACD/IUPAC Name]
1,3-Benzodioxole-4,5,6,7-d4 [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 173.0±15.0 °C at 760 mmHg
Vapour Pressure: 1.7±0.3 mmHg at 25°C
Enthalpy of Vaporization: 39.3±3.0 kJ/mol
Flash Point: 55.0±0.0 °C
Index of Refraction: 1.558
Molar Refractivity: 32.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.08
ACD/LogD (pH 5.5): 1.89
ACD/BCF (pH 5.5): 15.98
ACD/KOC (pH 5.5): 252.95
ACD/LogD (pH 7.4): 1.89
ACD/BCF (pH 7.4): 15.98
ACD/KOC (pH 7.4): 252.95
Polar Surface Area: 18 Å2
Polarizability: 12.9±0.5 10-24cm3
Surface Tension: 46.4±3.0 dyne/cm
Molar Volume: 100.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement