ChemSpider 2D Image | (4,4-Difluoro-1-piperidinyl)[4-hydroxy-2-(phenoxymethyl)-5-pyrimidinyl]methanone | C17H17F2N3O3

(4,4-Difluoro-1-piperidinyl)[4-hydroxy-2-(phenoxymethyl)-5-pyrimidinyl]methanone

  • Molecular FormulaC17H17F2N3O3
  • Average mass349.332 Da
  • Monoisotopic mass349.123810 Da
  • ChemSpider ID29493144

More details:

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

(4,4-Difluor-1-piperidinyl)[4-hydroxy-2-(phenoxymethyl)-5-pyrimidinyl]methanon [German] [ACD/IUPAC Name]
(4,4-Difluoro-1-piperidinyl)[4-hydroxy-2-(phenoxymethyl)-5-pyrimidinyl]methanone [ACD/IUPAC Name]
(4,4-Difluoro-1-pipéridinyl)[4-hydroxy-2-(phénoxyméthyl)-5-pyrimidinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (4,4-difluoro-1-piperidinyl)[4-hydroxy-2-(phenoxymethyl)-5-pyrimidinyl]- [ACD/Index Name]
5-[(4,4-difluoropiperidin-1-yl)carbonyl]-2-(phenoxymethyl)pyrimidin-4-ol

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

Density: 1.4±0.1 g/cm3
Boiling Point: 525.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 271.7±30.1 °C
Index of Refraction: 1.600
Molar Refractivity: 84.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 0.72
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 11.03
ACD/KOC (pH 5.5): 174.57
ACD/LogD (pH 7.4): 1.33
ACD/BCF (pH 7.4): 4.47
ACD/KOC (pH 7.4): 70.79
Polar Surface Area: 76 Å2
Polarizability: 33.7±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 248.3±5.0 cm3

Click to predict properties on the Chemicalize site


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