ChemSpider 2D Image | 3-Bromo-N-[1-(cyanomethyl)-4-piperidinyl]-5-fluorobenzamide | C14H15BrFN3O

3-Bromo-N-[1-(cyanomethyl)-4-piperidinyl]-5-fluorobenzamide

  • Molecular FormulaC14H15BrFN3O
  • Average mass340.191 Da
  • Monoisotopic mass339.038239 Da
  • ChemSpider ID30355379

More details:

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

3-Brom-N-[1-(cyanmethyl)-4-piperidinyl]-5-fluorbenzamid [German] [ACD/IUPAC Name]
3-Bromo-N-[1-(cyanomethyl)-4-piperidinyl]-5-fluorobenzamide [ACD/IUPAC Name]
3-Bromo-N-[1-(cyanométhyl)-4-pipéridinyl]-5-fluorobenzamide [French] [ACD/IUPAC Name]
Benzamide, 3-bromo-N-[1-(cyanomethyl)-4-piperidinyl]-5-fluoro- [ACD/Index Name]
3-BROMO-N-[1-(CYANOMETHYL)PIPERIDIN-4-YL]-5-FLUOROBENZAMIDE

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

Density: 1.5±0.1 g/cm3
Boiling Point: 446.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.5±3.0 kJ/mol
Flash Point: 223.8±28.7 °C
Index of Refraction: 1.599
Molar Refractivity: 77.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 1.65
ACD/BCF (pH 5.5): 10.07
ACD/KOC (pH 5.5): 170.88
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 12.50
ACD/KOC (pH 7.4): 212.03
Polar Surface Area: 56 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 56.9±5.0 dyne/cm
Molar Volume: 225.8±5.0 cm3

Click to predict properties on the Chemicalize site


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