ChemSpider 2D Image | 8-[(2-Butyl-1H-imidazol-4-yl)methyl]-3-isopropyl-1-(2-methoxyethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione | C21H35N5O3

8-[(2-Butyl-1H-imidazol-4-yl)methyl]-3-isopropyl-1-(2-methoxyethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione

  • Molecular FormulaC21H35N5O3
  • Average mass405.534 Da
  • Monoisotopic mass405.273987 Da
  • ChemSpider ID22128016

More details:

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

1,3,8-Triazaspiro[4.5]decane-2,4-dione, 8-[(2-butyl-1H-imidazol-4-yl)methyl]-1-(2-methoxyethyl)-3-(1-methylethyl)- [ACD/Index Name]
8-[(2-Butyl-1H-imidazol-4-yl)methyl]-3-isopropyl-1-(2-methoxyethyl)-1,3,8-triazaspiro[4.5]decan-2,4-dion [German] [ACD/IUPAC Name]
8-[(2-Butyl-1H-imidazol-4-yl)methyl]-3-isopropyl-1-(2-methoxyethyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione [ACD/IUPAC Name]
8-[(2-Butyl-1H-imidazol-4-yl)méthyl]-3-isopropyl-1-(2-méthoxyéthyl)-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: 567.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.2±3.0 kJ/mol
Flash Point: 297.1±32.9 °C
Index of Refraction: 1.571
Molar Refractivity: 111.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): -0.84
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.11
ACD/BCF (pH 7.4): 2.90
ACD/KOC (pH 7.4): 49.55
Polar Surface Area: 82 Å2
Polarizability: 44.1±0.5 10-24cm3
Surface Tension: 55.5±5.0 dyne/cm
Molar Volume: 338.8±5.0 cm3

Click to predict properties on the Chemicalize site


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