ChemSpider 2D Image | 2-Bromo-3,3,3-trifluoropropyl methanesulfonate | C4H6BrF3O3S

2-Bromo-3,3,3-trifluoropropyl methanesulfonate

  • Molecular FormulaC4H6BrF3O3S
  • Average mass271.053 Da
  • Monoisotopic mass269.917297 Da
  • ChemSpider ID73998922

More details:

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

1-Propanol, 2-bromo-3,3,3-trifluoro-, methanesulfonate [ACD/Index Name]
2-Brom-3,3,3-trifluorpropyl-methansulfonat [German] [ACD/IUPAC Name]
2-Bromo-3,3,3-trifluoropropyl methanesulfonate [ACD/IUPAC Name]
Méthanesulfonate de 2-bromo-3,3,3-trifluoropropyle [French] [ACD/IUPAC Name]
2-Bromo-3,3,3-trifluoropropyl mesylate
MFCD31695495

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

Density: 1.8±0.1 g/cm3
Boiling Point: 257.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.5±3.0 kJ/mol
Flash Point: 109.5±27.3 °C
Index of Refraction: 1.429
Molar Refractivity: 39.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.81
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 18.03
ACD/KOC (pH 5.5): 275.90
ACD/LogD (pH 7.4): 1.96
ACD/BCF (pH 7.4): 18.03
ACD/KOC (pH 7.4): 275.90
Polar Surface Area: 52 Å2
Polarizability: 15.5±0.5 10-24cm3
Surface Tension: 34.2±3.0 dyne/cm
Molar Volume: 151.9±3.0 cm3

Click to predict properties on the Chemicalize site


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