ChemSpider 2D Image | (3-(Benzylcarbamoyl)-4-fluorophenyl)boronic acid | C14H13BFNO3

(3-(Benzylcarbamoyl)-4-fluorophenyl)boronic acid

  • Molecular FormulaC14H13BFNO3
  • Average mass273.067 Da
  • Monoisotopic mass273.097260 Da
  • ChemSpider ID21469838

More details:

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

(3-(Benzylcarbamoyl)-4-fluorophenyl)boronic acid
[3-(Benzylcarbamoyl)-4-fluorophenyl]boronic acid [ACD/IUPAC Name]
[3-(Benzylcarbamoyl)-4-fluorphenyl]borsäure [German] [ACD/IUPAC Name]
874219-22-4 [RN]
Acide [3-(benzylcarbamoyl)-4-fluorophényl]boronique [French] [ACD/IUPAC Name]
B-[4-Fluoro-3-[[(phenylmethyl)amino]carbonyl]phenyl]boronic acid
Boronic acid, B-[4-fluoro-3-[[(phenylmethyl)amino]carbonyl]phenyl]- [ACD/Index Name]
??3-(Benzylcarbamoyl)-4-fluorophenylboronic acid
[3-(Benzylcarbamoyl)-4-fluoro-phenyl]boronic acid
[4-fluoro-3-[oxo-[(phenylmethyl)amino]methyl]phenyl]boronic acid
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.596
Molar Refractivity: 71.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.80
ACD/KOC (pH 5.5): 261.90
ACD/LogD (pH 7.4): 1.80
ACD/BCF (pH 7.4): 13.02
ACD/KOC (pH 7.4): 203.03
Polar Surface Area: 70 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 53.2±5.0 dyne/cm
Molar Volume: 209.1±5.0 cm3

Click to predict properties on the Chemicalize site


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