ChemSpider 2D Image | 4-{[4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-2-pyrimidinyl]amino}cyclohexanol | C20H22N4O2

4-{[4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-2-pyrimidinyl]amino}cyclohexanol

  • Molecular FormulaC20H22N4O2
  • Average mass350.414 Da
  • Monoisotopic mass350.174286 Da
  • ChemSpider ID34949051

More details:






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

4-{[4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-2-pyrimidinyl]amino}cyclohexanol [German] [ACD/IUPAC Name]
4-{[4-(5-Methyl-3-phenyl-1,2-oxazol-4-yl)-2-pyrimidinyl]amino}cyclohexanol [ACD/IUPAC Name]
4-{[4-(5-Méthyl-3-phényl-1,2-oxazol-4-yl)-2-pyrimidinyl]amino}cyclohexanol [French] [ACD/IUPAC Name]
Cyclohexanol, 4-[[4-(5-methyl-3-phenyl-4-isoxazolyl)-2-pyrimidinyl]amino]- [ACD/Index Name]
erk000075

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 547.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 87.0±3.0 kJ/mol
Flash Point: 285.0±32.9 °C
Index of Refraction: 1.632
Molar Refractivity: 99.1±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.79
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 55.79
ACD/KOC (pH 5.5): 618.99
ACD/LogD (pH 7.4): 2.60
ACD/BCF (pH 7.4): 55.85
ACD/KOC (pH 7.4): 619.64
Polar Surface Area: 84 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 56.4±3.0 dyne/cm
Molar Volume: 277.7±3.0 cm3

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