Found 16 results

Search term: MF = 'C_{6}H_{5}BF_{3}NO_{2}'
ChemSpider 2D Image | (2-Amino-3,5,6-trifluorophenyl)boronic acid | C6H5BF3NO2

(2-Amino-3,5,6-trifluorophenyl)boronic acid

  • Molecular FormulaC6H5BF3NO2
  • Average mass190.916 Da
  • Monoisotopic mass191.036545 Da
  • ChemSpider ID123964560

More details:

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

(2-Amino-3,5,6-trifluorophenyl)boronic acid [ACD/IUPAC Name]
(2-Amino-3,5,6-trifluorphenyl)borsäure [German] [ACD/IUPAC Name]
Acide (2-amino-3,5,6-trifluorophényl)boronique [French] [ACD/IUPAC Name]
Boronic acid, B-(2-amino-3,5,6-trifluorophenyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 337.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.3±3.0 kJ/mol
Flash Point: 158.2±30.7 °C
Index of Refraction: 1.508
Molar Refractivity: 37.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 4
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.32
ACD/LogD (pH 5.5): 1.10
ACD/BCF (pH 5.5): 3.84
ACD/KOC (pH 5.5): 86.87
ACD/LogD (pH 7.4): -0.03
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 6.50
Polar Surface Area: 66 Å2
Polarizability: 14.8±0.5 10-24cm3
Surface Tension: 44.0±5.0 dyne/cm
Molar Volume: 124.9±5.0 cm3

Click to predict properties on the Chemicalize site


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