ChemSpider 2D Image | (3-(cyclopentylcarbamoyl)-4-fluorophenyl)boronic acid | C12H15BFNO3

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

  • Molecular FormulaC12H15BFNO3
  • Average mass251.062 Da
  • Monoisotopic mass251.112900 Da
  • ChemSpider ID26638947

More details:

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

(3-(cyclopentylcarbamoyl)-4-fluorophenyl)boronic acid
[3-(Cyclopentylcarbamoyl)-4-fluorophenyl]boronic acid [ACD/IUPAC Name]
[3-(Cyclopentylcarbamoyl)-4-fluorphenyl]borsäure [German] [ACD/IUPAC Name]
1449132-66-4 [RN]
Acide [3-(cyclopentylcarbamoyl)-4-fluorophényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[(cyclopentylamino)carbonyl]-4-fluorophenyl]- [ACD/Index Name]
3-(CYCLOPENTYLCARBAMOYL)-4-FLUOROPHENYLBORONIC ACID
3-Cyclopentylcarbamoyl-4-fluorobenzeneboronic acid
MFCD20040242 [MDL number]
  • Miscellaneous

    • Safety:

      26-37 Alfa Aesar H54739
      26-37-60 Alfa Aesar H54739
      36/37/38 Alfa Aesar H54739
      H315-H319-H335 Alfa Aesar H54739
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar H54739
      Warning Alfa Aesar H54739
      WARNING: Irritates lungs, eyes, skin Alfa Aesar H54739

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: 1.553
Molar Refractivity: 62.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.36
ACD/LogD (pH 5.5): 1.40
ACD/BCF (pH 5.5): 6.79
ACD/KOC (pH 5.5): 136.96
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 5.28
ACD/KOC (pH 7.4): 106.47
Polar Surface Area: 70 Å2
Polarizability: 24.9±0.5 10-24cm3
Surface Tension: 48.9±5.0 dyne/cm
Molar Volume: 196.5±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement