ChemSpider 2D Image | 3-Borono-N-(3-fluorophenyl)benzamide | C13H11BFNO3

3-Borono-N-(3-fluorophenyl)benzamide

  • Molecular FormulaC13H11BFNO3
  • Average mass259.041 Da
  • Monoisotopic mass259.081604 Da
  • ChemSpider ID21469196

More details:

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

(3-((3-Fluorophenyl)carbamoyl)phenyl)boronic acid
{3-[(3-Fluorophenyl)carbamoyl]phenyl}boronic acid [ACD/IUPAC Name]
{3-[(3-Fluorphenyl)carbamoyl]phenyl}borsäure [German] [ACD/IUPAC Name]
3-Borono-N-(3-fluorophenyl)benzamide
874288-34-3 [RN]
Acide {3-[(3-fluorophényl)carbamoyl]phényl}boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-[[(3-fluorophenyl)amino]carbonyl]phenyl]- [ACD/Index Name]
[3-[(3-fluoroanilino)-oxomethyl]phenyl]boronic acid
[3-[(3-Fluorophenyl)carbamoyl]phenyl]boronic acid
[874288-34-3] [RN]
More...
  • Miscellaneous

    • Safety:

      26-37-60 Alfa Aesar H52959
      36/37/38 Alfa Aesar H52959
      H315-H319-H335 Alfa Aesar H52959
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar H52959
      Warning Alfa Aesar H52959
      WARNING: Irritates lungs, eyes, skin Alfa Aesar H52959

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: 1.606
Molar Refractivity: 66.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.48
ACD/LogD (pH 5.5): 2.28
ACD/BCF (pH 5.5): 31.52
ACD/KOC (pH 5.5): 410.99
ACD/LogD (pH 7.4): 2.16
ACD/BCF (pH 7.4): 23.95
ACD/KOC (pH 7.4): 312.20
Polar Surface Area: 70 Å2
Polarizability: 26.4±0.5 10-24cm3
Surface Tension: 54.8±5.0 dyne/cm
Molar Volume: 192.8±5.0 cm3

Click to predict properties on the Chemicalize site


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