Found 92 results

Search term: MF = 'C_{19}H_{22}FN_{7}O_{2}'
ChemSpider 2D Image | 5-Fluoro-6-{4-[2-(1H-1,2,4-triazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undec-9-yl}nicotinonitrile | C19H22FN7O2

5-Fluoro-6-{4-[2-(1H-1,2,4-triazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undec-9-yl}nicotinonitrile

  • Molecular FormulaC19H22FN7O2
  • Average mass399.422 Da
  • Monoisotopic mass399.181915 Da
  • ChemSpider ID71308244

More details:

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

3-Pyridinecarbonitrile, 5-fluoro-6-[4-[1-oxo-2-(1H-1,2,4-triazol-1-yl)propyl]-1-oxa-4,9-diazaspiro[5.5]undec-9-yl]- [ACD/Index Name]
5-Fluor-6-{4-[2-(1H-1,2,4-triazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undec-9-yl}nicotinonitril [German] [ACD/IUPAC Name]
5-Fluoro-6-{4-[2-(1H-1,2,4-triazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undec-9-yl}nicotinonitrile [ACD/IUPAC Name]
5-Fluoro-6-{4-[2-(1H-1,2,4-triazol-1-yl)propanoyl]-1-oxa-4,9-diazaspiro[5.5]undéc-9-yl}nicotinonitrile [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 661.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 353.8±34.3 °C
Index of Refraction: 1.680
Molar Refractivity: 105.3±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.76
ACD/LogD (pH 5.5): 1.24
ACD/BCF (pH 5.5): 5.19
ACD/KOC (pH 5.5): 113.07
ACD/LogD (pH 7.4): 1.25
ACD/BCF (pH 7.4): 5.20
ACD/KOC (pH 7.4): 113.25
Polar Surface Area: 100 Å2
Polarizability: 41.8±0.5 10-24cm3
Surface Tension: 58.3±7.0 dyne/cm
Molar Volume: 278.7±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement