ChemSpider 2D Image | 3-(3,4-Difluorophenyl)-5-(6-isopropyl-3-pyridazinyl)-4,5,6,7-tetrahydro[1,2]oxazolo[4,5-c]pyridine | C19H18F2N4O

3-(3,4-Difluorophenyl)-5-(6-isopropyl-3-pyridazinyl)-4,5,6,7-tetrahydro[1,2]oxazolo[4,5-c]pyridine

  • Molecular FormulaC19H18F2N4O
  • Average mass356.369 Da
  • Monoisotopic mass356.144867 Da
  • ChemSpider ID29612781

More details:

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

3-(3,4-Difluorophenyl)-5-(6-isopropyl-3-pyridazinyl)-4,5,6,7-tetrahydro[1,2]oxazolo[4,5-c]pyridine [ACD/IUPAC Name]
3-(3,4-Difluorophényl)-5-(6-isopropyl-3-pyridazinyl)-4,5,6,7-tétrahydro[1,2]oxazolo[4,5-c]pyridine [French] [ACD/IUPAC Name]
3-(3,4-Difluorphenyl)-5-(6-isopropyl-3-pyridazinyl)-4,5,6,7-tetrahydro[1,2]oxazolo[4,5-c]pyridin [German] [ACD/IUPAC Name]
Isoxazolo[4,5-c]pyridine, 3-(3,4-difluorophenyl)-4,5,6,7-tetrahydro-5-[6-(1-methylethyl)-3-pyridazinyl]- [ACD/Index Name]
3-(3,4-difluorophenyl)-5-(6-isopropylpyridazin-3-yl)-4,5,6,7-tetrahydroisoxazolo[4,5-c]pyridine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 592.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.3±3.0 kJ/mol
Flash Point: 312.0±30.1 °C
Index of Refraction: 1.575
Molar Refractivity: 91.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.36
ACD/LogD (pH 5.5): 3.24
ACD/BCF (pH 5.5): 165.69
ACD/KOC (pH 5.5): 1293.21
ACD/LogD (pH 7.4): 3.31
ACD/BCF (pH 7.4): 192.09
ACD/KOC (pH 7.4): 1499.30
Polar Surface Area: 55 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 49.8±3.0 dyne/cm
Molar Volume: 277.8±3.0 cm3

Click to predict properties on the Chemicalize site


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