ChemSpider 2D Image | 2,2-Difluoro-4-(3,4,4-trifluoro-3-buten-1-yn-1-yl)-1,3-benzodioxole | C11H3F5O2

2,2-Difluoro-4-(3,4,4-trifluoro-3-buten-1-yn-1-yl)-1,3-benzodioxole

  • Molecular FormulaC11H3F5O2
  • Average mass262.132 Da
  • Monoisotopic mass262.005310 Da
  • ChemSpider ID86561548

More details:

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

1,3-Benzodioxole, 2,2-difluoro-4-(3,4,4-trifluoro-3-buten-1-yn-1-yl)- [ACD/Index Name]
2,2-Difluor-4-(3,4,4-trifluor-3-buten-1-in-1-yl)-1,3-benzodioxol [German] [ACD/IUPAC Name]
2,2-Difluoro-4-(3,4,4-trifluoro-3-buten-1-yn-1-yl)-1,3-benzodioxole [ACD/IUPAC Name]
2,2-Difluoro-4-(3,4,4-trifluoro-3-butén-1-yn-1-yl)-1,3-benzodioxole [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 203.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.4±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.2±3.0 kJ/mol
Flash Point: 83.3±23.2 °C
Index of Refraction: 1.501
Molar Refractivity: 49.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 5.01
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 372.64
ACD/KOC (pH 5.5): 2410.65
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 372.64
ACD/KOC (pH 7.4): 2410.65
Polar Surface Area: 18 Å2
Polarizability: 19.6±0.5 10-24cm3
Surface Tension: 36.2±5.0 dyne/cm
Molar Volume: 167.6±5.0 cm3

Click to predict properties on the Chemicalize site


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