ChemSpider 2D Image | (4-Fluoro-2-isopropylphenyl)boronic acid | C9H12BFO2

(4-Fluoro-2-isopropylphenyl)boronic acid

  • Molecular FormulaC9H12BFO2
  • Average mass182.000 Da
  • Monoisotopic mass182.091446 Da
  • ChemSpider ID97199713

More details:

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

(4-Fluor-2-isopropylphenyl)borsäure [German] [ACD/IUPAC Name]
(4-Fluoro-2-isopropylphenyl)boronic acid [ACD/IUPAC Name]
Acide (4-fluoro-2-isopropylphényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[4-fluoro-2-(1-methylethyl)phenyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 286.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 55.5±3.0 kJ/mol
Flash Point: 127.0±30.1 °C
Index of Refraction: 1.497
Molar Refractivity: 47.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.98
ACD/LogD (pH 5.5): 2.53
ACD/BCF (pH 5.5): 49.52
ACD/KOC (pH 5.5): 568.45
ACD/LogD (pH 7.4): 2.52
ACD/BCF (pH 7.4): 47.54
ACD/KOC (pH 7.4): 545.65
Polar Surface Area: 40 Å2
Polarizability: 18.7±0.5 10-24cm3
Surface Tension: 35.9±5.0 dyne/cm
Molar Volume: 161.5±5.0 cm3

Click to predict properties on the Chemicalize site


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