ChemSpider 2D Image | 2,2',2''-[Nitrilotris(methylene-1H-1,2,3-triazole-4,1-diyl)]triethanol | C15H24N10O3

2,2',2''-[Nitrilotris(methylene-1H-1,2,3-triazole-4,1-diyl)]triethanol

  • Molecular FormulaC15H24N10O3
  • Average mass392.416 Da
  • Monoisotopic mass392.203278 Da
  • ChemSpider ID35033690

More details:






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

1H-1,2,3-Triazole-1-ethanol, 4,4',4''-[nitrilotris(methylene)]tris- [ACD/Index Name]
2,2',2''-[nitrilotris(Methanediyl-1h-1,2,3-Triazole-4,1-Diyl)]triethanol
2,2',2''-[Nitrilotris(methylen-1H-1,2,3-triazol-4,1-diyl)]triethanol [German] [ACD/IUPAC Name]
2,2',2''-[Nitrilotris(methylene-1H-1,2,3-triazole-4,1-diyl)]triethanol [ACD/IUPAC Name]
2,2',2''-[Nitrilotris(méthylène-1H-1,2,3-triazole-4,1-diyl)]triéthanol [French] [ACD/IUPAC Name]
1P0

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.6±0.1 g/cm3
Boiling Point: 688.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.0±3.0 kJ/mol
Flash Point: 370.3±34.3 °C
Index of Refraction: 1.732
Molar Refractivity: 100.7±0.5 cm3
#H bond acceptors: 13
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: -4.03
ACD/LogD (pH 5.5): -2.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.04
ACD/LogD (pH 7.4): -2.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.04
Polar Surface Area: 156 Å2
Polarizability: 39.9±0.5 10-24cm3
Surface Tension: 75.2±7.0 dyne/cm
Molar Volume: 251.7±7.0 cm3

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