Found 15 results

Search term: MF = 'C_{13}H_{11}BBrFO_{3}'
ChemSpider 2D Image | (2-benzyloxy-3-bromo-6-fluoro-phenyl)boronic acid | C13H11BBrFO3

(2-benzyloxy-3-bromo-6-fluoro-phenyl)boronic acid

  • Molecular FormulaC13H11BBrFO3
  • Average mass324.938 Da
  • Monoisotopic mass323.996857 Da
  • ChemSpider ID24539856

More details:

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

2-(benzyloxy)-3-bromo-6-fluorophenylboronic acid

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

Density: 1.6±0.1 g/cm3
Boiling Point: 454.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.3±3.0 kJ/mol
Flash Point: 228.9±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 72.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.77
ACD/LogD (pH 5.5): 3.58
ACD/BCF (pH 5.5): 308.28
ACD/KOC (pH 5.5): 2097.13
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 154.83
ACD/KOC (pH 7.4): 1053.27
Polar Surface Area: 50 Å2
Polarizability: 28.6±0.5 10-24cm3
Surface Tension: 54.3±5.0 dyne/cm
Molar Volume: 207.2±5.0 cm3

Click to predict properties on the Chemicalize site


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