ChemSpider 2D Image | 1-Isobutyl-3-methyl-8-(tetrahydro-2H-pyran-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione | C17H29N3O3

1-Isobutyl-3-methyl-8-(tetrahydro-2H-pyran-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione

  • Molecular FormulaC17H29N3O3
  • Average mass323.431 Da
  • Monoisotopic mass323.220886 Da
  • ChemSpider ID22123323

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 3-methyl-1-(2-methylpropyl)-8-(tetrahydro-2H-pyran-4-yl)- [ACD/Index Name]
1-Isobutyl-3-methyl-8-(tetrahydro-2H-pyran-4-yl)-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
1-Isobutyl-3-methyl-8-(tetrahydro-2H-pyran-4-yl)-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
1-Isobutyl-3-méthyl-8-(tétrahydro-2H-pyran-4-yl)-1,3,8-triazaspiro[4.5]décane-2,4-dione [French] [ACD/IUPAC 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: 429.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.4±3.0 kJ/mol
Flash Point: 213.4±31.5 °C
Index of Refraction: 1.559
Molar Refractivity: 88.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): -0.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 3.28
ACD/KOC (pH 7.4): 38.01
Polar Surface Area: 53 Å2
Polarizability: 35.0±0.5 10-24cm3
Surface Tension: 49.3±5.0 dyne/cm
Molar Volume: 273.3±5.0 cm3

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