ChemSpider 2D Image | [3-Fluoro-4-(1-piperidinylcarbonyl)phenyl]boronic acid | C12H15BFNO3

[3-Fluoro-4-(1-piperidinylcarbonyl)phenyl]boronic acid

  • Molecular FormulaC12H15BFNO3
  • Average mass251.062 Da
  • Monoisotopic mass251.112900 Da
  • ChemSpider ID21469890

More details:

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

(3-Fluoro-4-(piperidine-1-carbonyl)-phenyl)boronic acid
[3-Fluor-4-(1-piperidinylcarbonyl)phenyl]borsäure [German] [ACD/IUPAC Name]
[3-Fluoro-4-(1-piperidinylcarbonyl)phenyl]boronic acid [ACD/IUPAC Name]
3-Fluoro-4-(piperidin-1-ylcarbonyl)benzeneboronic acid
874289-10-8 [RN]
Acide [3-fluoro-4-(1-pipéridinylcarbonyl)phényl]boronique [French] [ACD/IUPAC Name]
Boronic acid, B-[3-fluoro-4-(1-piperidinylcarbonyl)phenyl]- [ACD/Index Name]
(3-Fluoro-4-(piperidine-1-carbonyl)phenyl)boronic acid
[3-fluoro-4-(piperidine-1-carbonyl)phenyl]boronic acid
[3-fluoro-4-[oxo(1-piperidinyl)methyl]phenyl]boronic acid
More...

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

CCRIS 4693 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      26-37-60 Alfa Aesar H52680
      36/37/38 Alfa Aesar H52680
      H315-H319-H335 Alfa Aesar H52680
      P261-P280-P305+P351+P338-P304+P340-P405-P501a Alfa Aesar H52680
      Warning Alfa Aesar H52680
      WARNING: Irritates skin and eyes, harmful if swallowed Alfa Aesar H52680

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

Density: 1.3±0.1 g/cm3
Boiling Point: 466.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.7±3.0 kJ/mol
Flash Point: 235.8±31.5 °C
Index of Refraction: 1.562
Molar Refractivity: 63.1±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 3.82
ACD/KOC (pH 5.5): 90.21
ACD/LogD (pH 7.4): 0.60
ACD/BCF (pH 7.4): 1.28
ACD/KOC (pH 7.4): 30.11
Polar Surface Area: 61 Å2
Polarizability: 25.0±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 194.7±5.0 cm3

Click to predict properties on the Chemicalize site


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