Found 18 results

Search term: C12H12O7S (Found by molecular formula)
ChemSpider 2D Image | Methyl {[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfonyl}acetate | C12H12O7S

Methyl {[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfonyl}acetate

  • Molecular FormulaC12H12O7S
  • Average mass300.284 Da
  • Monoisotopic mass300.030365 Da
  • ChemSpider ID45181532

More details:

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

{[2-(1,3-Benzodioxol-5-yl)-2-oxoéthyl]sulfonyl}acétate de méthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfonyl]-, methyl ester [ACD/Index Name]
Methyl {[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfonyl}acetate [ACD/IUPAC Name]
Methyl-{[2-(1,3-benzodioxol-5-yl)-2-oxoethyl]sulfonyl}acetat [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 560.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.3±3.0 kJ/mol
Flash Point: 292.9±30.1 °C
Index of Refraction: 1.561
Molar Refractivity: 66.8±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.59
ACD/LogD (pH 5.5): 0.42
ACD/BCF (pH 5.5): 1.22
ACD/KOC (pH 5.5): 40.13
ACD/LogD (pH 7.4): 0.42
ACD/BCF (pH 7.4): 1.22
ACD/KOC (pH 7.4): 40.13
Polar Surface Area: 104 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 60.5±3.0 dyne/cm
Molar Volume: 206.2±3.0 cm3

Click to predict properties on the Chemicalize site


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