ChemSpider 2D Image | 1-(1,3-Benzodioxol-5-yl)-2,2-difluoroethanone | C9H6F2O3

1-(1,3-Benzodioxol-5-yl)-2,2-difluoroethanone

  • Molecular FormulaC9H6F2O3
  • Average mass200.139 Da
  • Monoisotopic mass200.028503 Da
  • ChemSpider ID24186470

More details:

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

1-(1,3-Benzodioxol-5-yl)-2,2-difluorethanon [German] [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2,2-difluoroethanone [ACD/IUPAC Name]
1-(1,3-Benzodioxol-5-yl)-2,2-difluoroéthanone [French] [ACD/IUPAC Name]
Ethanone, 1-(1,3-benzodioxol-5-yl)-2,2-difluoro- [ACD/Index Name]
1-(1,3-dioxaindan-5-yl)-2,2-difluoroethan-1-one
1-(2H-1,3-Benzodioxol-5-yl)-2,2-difluoroethan-1-one
1-(benzo[d][1,3]dioxol-5-yl)-2,2-difluoroethanone
437552-71-1 [RN]
Ethanone, 1-(1,3-benzodioxol-5-yl)-2,2-difluoro- (9CI)
ETHANONE,1-(1,3-BENZODIOXOL-5-YL)-2,2-DIFLUORO-
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 306.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.7±3.0 kJ/mol
Flash Point: 134.5±22.8 °C
Index of Refraction: 1.508
Molar Refractivity: 42.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.89
ACD/LogD (pH 5.5): 1.41
ACD/BCF (pH 5.5): 7.01
ACD/KOC (pH 5.5): 140.23
ACD/LogD (pH 7.4): 1.41
ACD/BCF (pH 7.4): 7.01
ACD/KOC (pH 7.4): 140.23
Polar Surface Area: 36 Å2
Polarizability: 16.9±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 143.4±3.0 cm3

Click to predict properties on the Chemicalize site


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