Found 3021 results

Search term: MF = 'C_{15}H_{19}F_{2}N_{3}O'
ChemSpider 2D Image | 4-({[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}amino)-3,5-difluorobenzonitrile | C15H19F2N3O

4-({[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}amino)-3,5-difluorobenzonitrile

  • Molecular FormulaC15H19F2N3O
  • Average mass295.328 Da
  • Monoisotopic mass295.149628 Da
  • ChemSpider ID30180018

More details:

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

4-({[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}amino)-3,5-difluorbenzonitril [German] [ACD/IUPAC Name]
4-({[4-(Dimethylamino)tetrahydro-2H-pyran-4-yl]methyl}amino)-3,5-difluorobenzonitrile [ACD/IUPAC Name]
4-({[4-(Diméthylamino)tétrahydro-2H-pyran-4-yl]méthyl}amino)-3,5-difluorobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-[[[4-(dimethylamino)tetrahydro-2H-pyran-4-yl]methyl]amino]-3,5-difluoro- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 402.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.3±3.0 kJ/mol
Flash Point: 197.1±28.7 °C
Index of Refraction: 1.538
Molar Refractivity: 75.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): -0.77
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 2.13
ACD/KOC (pH 7.4): 39.04
Polar Surface Area: 48 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 45.2±5.0 dyne/cm
Molar Volume: 242.3±5.0 cm3

Click to predict properties on the Chemicalize site


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