ChemSpider 2D Image | 3-(2,2-Difluoroethoxy)phenylboronic acid | C8H9BF2O3

3-(2,2-Difluoroethoxy)phenylboronic acid

  • Molecular FormulaC8H9BF2O3
  • Average mass201.963 Da
  • Monoisotopic mass202.061279 Da
  • ChemSpider ID22499212

More details:

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

(3-(2,2-Difluoroethoxy)phenyl)boronic acid
[3-(2,2-Difluorethoxy)phenyl]borsäure [German] [ACD/IUPAC Name]
[3-(2,2-Difluoroethoxy)phenyl]boronic acid [ACD/IUPAC Name]
3-(2,2-Difluoroethoxy)phenylboronic acid
958452-33-0 [RN]
Acide [3-(2,2-difluoroéthoxy)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-(2,2-difluoroethoxy)phenyl]- [ACD/Index Name]
3-(2,2-Difluoroethoxy)phenylboronicacid
MFCD11111925 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 340.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.6±3.0 kJ/mol
Flash Point: 159.7±30.7 °C
Index of Refraction: 1.479
Molar Refractivity: 44.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.81
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 14.50
ACD/KOC (pH 5.5): 235.78
ACD/LogD (pH 7.4): 1.72
ACD/BCF (pH 7.4): 11.30
ACD/KOC (pH 7.4): 183.64
Polar Surface Area: 50 Å2
Polarizability: 17.6±0.5 10-24cm3
Surface Tension: 36.7±5.0 dyne/cm
Molar Volume: 157.1±5.0 cm3

Click to predict properties on the Chemicalize site


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