ChemSpider 2D Image | 6-[2-(Methylsulfonyl)ethoxy]-1,3-benzodioxole-5-carbaldehyde | C11H12O6S

6-[2-(Methylsulfonyl)ethoxy]-1,3-benzodioxole-5-carbaldehyde

  • Molecular FormulaC11H12O6S
  • Average mass272.274 Da
  • Monoisotopic mass272.035461 Da
  • ChemSpider ID39098138

More details:

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

1,3-Benzodioxole-5-carboxaldehyde, 6-[2-(methylsulfonyl)ethoxy]- [ACD/Index Name]
6-[2-(Methylsulfonyl)ethoxy]-1,3-benzodioxol-5-carbaldehyd [German] [ACD/IUPAC Name]
6-[2-(Methylsulfonyl)ethoxy]-1,3-benzodioxole-5-carbaldehyde [ACD/IUPAC Name]
6-[2-(Méthylsulfonyl)éthoxy]-1,3-benzodioxole-5-carbaldéhyde [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 519.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 79.3±3.0 kJ/mol
Flash Point: 268.2±30.1 °C
Index of Refraction: 1.568
Molar Refractivity: 62.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -0.14
ACD/LogD (pH 5.5): 0.13
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.05
ACD/LogD (pH 7.4): 0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.05
Polar Surface Area: 87 Å2
Polarizability: 24.7±0.5 10-24cm3
Surface Tension: 58.8±3.0 dyne/cm
Molar Volume: 190.3±3.0 cm3

Click to predict properties on the Chemicalize site


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