ChemSpider 2D Image | 4-Cyano-2-fluorophenylboronic acid | C7H5BFNO2

4-Cyano-2-fluorophenylboronic acid

  • Molecular FormulaC7H5BFNO2
  • Average mass164.930 Da
  • Monoisotopic mass165.039734 Da
  • ChemSpider ID21109323

More details:

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

(4-Cyan-2-fluorphenyl)borsäure [German] [ACD/IUPAC Name]
(4-Cyano-2-fluorophenyl)boronic acid [ACD/IUPAC Name]
1150114-77-4 [RN]
4-Cyano-2-fluorophenylboronic acid
Acide (4-cyano-2-fluorophényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(4-cyano-2-fluorophenyl)- [ACD/Index Name]
MFCD07644472 [MDL number]
(4-Cyano-2-fluorophenyl) boronic acid
(4-Cyano-2-fluorophenyl)boronicacid
[1150114-77-4] [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 347.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.5±3.0 kJ/mol
Flash Point: 164.2±30.7 °C
Index of Refraction: 1.535
Molar Refractivity: 38.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.84
ACD/LogD (pH 5.5): 1.06
ACD/BCF (pH 5.5): 3.76
ACD/KOC (pH 5.5): 89.23
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.44
ACD/KOC (pH 7.4): 34.14
Polar Surface Area: 64 Å2
Polarizability: 15.1±0.5 10-24cm3
Surface Tension: 51.6±5.0 dyne/cm
Molar Volume: 121.9±5.0 cm3

Click to predict properties on the Chemicalize site


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