ChemSpider 2D Image | {4-[(2,6-Difluorobenzyl)oxy]phenyl}boronic acid | C13H11BF2O3

{4-[(2,6-Difluorobenzyl)oxy]phenyl}boronic acid

  • Molecular FormulaC13H11BF2O3
  • Average mass264.032 Da
  • Monoisotopic mass264.076935 Da
  • ChemSpider ID68998496

More details:

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

{4-[(2,6-Difluorbenzyl)oxy]phenyl}borsäure [German] [ACD/IUPAC Name]
{4-[(2,6-Difluorobenzyl)oxy]phenyl}boronic acid [ACD/IUPAC Name]
Acide {4-[(2,6-difluorobenzyl)oxy]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-[(2,6-difluorophenyl)methoxy]phenyl]- [ACD/Index Name]
(4-((2,6-Difluorobenzyl)oxy)phenyl)boronic acid
{4-[(2,6-difluorophenyl)methoxy]phenyl}boronic acid
2246544-61-4 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 412.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 70.1±3.0 kJ/mol
Flash Point: 203.0±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 64.6±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.30
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 105.64
ACD/KOC (pH 5.5): 977.65
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 99.90
ACD/KOC (pH 7.4): 924.55
Polar Surface Area: 50 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 46.2±5.0 dyne/cm
Molar Volume: 199.0±5.0 cm3

Click to predict properties on the Chemicalize site


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