ChemSpider 2D Image | 7-(2,3-Dimethoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazine | C24H29N3O3

7-(2,3-Dimethoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazine

  • Molecular FormulaC24H29N3O3
  • Average mass407.505 Da
  • Monoisotopic mass407.220886 Da
  • ChemSpider ID30654179

More details:

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

7-(2,3-Dimethoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazin [German] [ACD/IUPAC Name]
7-(2,3-Dimethoxybenzyl)-3-(2-methyl-2-propanyl)-1-phenyl-1,4,6,7-tetrahydropyrazolo[3,4-d][1,3]oxazine [ACD/IUPAC Name]
7-(2,3-Diméthoxybenzyl)-3-(2-méthyl-2-propanyl)-1-phényl-1,4,6,7-tétrahydropyrazolo[3,4-d][1,3]oxazine [French] [ACD/IUPAC Name]
Pyrazolo[3,4-d][1,3]oxazine, 7-[(2,3-dimethoxyphenyl)methyl]-3-(1,1-dimethylethyl)-1,4,6,7-tetrahydro-1-phenyl- [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: 558.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.0±3.0 kJ/mol
Flash Point: 291.2±30.1 °C
Index of Refraction: 1.585
Molar Refractivity: 117.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 4.33
ACD/BCF (pH 5.5): 1151.68
ACD/KOC (pH 5.5): 5366.81
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1181.41
ACD/KOC (pH 7.4): 5505.31
Polar Surface Area: 49 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 351.4±7.0 cm3

Click to predict properties on the Chemicalize site


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