ChemSpider 2D Image | 9-(2-Hydroxyethyl)-1-methyl-4-(2H-tetrazol-2-ylacetyl)-1,4,9-triazaspiro[5.6]dodecan-10-one | C15H25N7O3

9-(2-Hydroxyethyl)-1-methyl-4-(2H-tetrazol-2-ylacetyl)-1,4,9-triazaspiro[5.6]dodecan-10-one

  • Molecular FormulaC15H25N7O3
  • Average mass351.404 Da
  • Monoisotopic mass351.201874 Da
  • ChemSpider ID62705414

More details:

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

1,4,9-Triazaspiro[5.6]dodecan-10-one, 9-(2-hydroxyethyl)-1-methyl-4-[2-(2H-tetrazol-2-yl)acetyl]- [ACD/Index Name]
9-(2-Hydroxyethyl)-1-methyl-4-(2H-tetrazol-2-ylacetyl)-1,4,9-triazaspiro[5.6]dodecan-10-on [German] [ACD/IUPAC Name]
9-(2-Hydroxyethyl)-1-methyl-4-(2H-tetrazol-2-ylacetyl)-1,4,9-triazaspiro[5.6]dodecan-10-one [ACD/IUPAC Name]
9-(2-Hydroxyéthyl)-1-méthyl-4-[2-(2H-tétrazol-2-yl)acétyl]-1,4,9-triazaspiro[5.6]dodécan-10-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 634.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.6±3.0 kJ/mol
Flash Point: 337.8±34.3 °C
Index of Refraction: 1.684
Molar Refractivity: 91.9±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -0.66
ACD/LogD (pH 5.5): -3.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.48
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.95
Polar Surface Area: 108 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 65.6±7.0 dyne/cm
Molar Volume: 242.2±7.0 cm3

Click to predict properties on the Chemicalize site


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