ChemSpider 2D Image | N-{[1-(4-Methoxy-2-butanyl)-1,2,3-triazolidin-4-yl]methyl}-2-methyl-2-propanamine | C12H28N4O

N-{[1-(4-Methoxy-2-butanyl)-1,2,3-triazolidin-4-yl]methyl}-2-methyl-2-propanamine

  • Molecular FormulaC12H28N4O
  • Average mass244.377 Da
  • Monoisotopic mass244.226318 Da
  • ChemSpider ID112205020

More details:






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

1,2,3-Triazolidine-4-methanamine, N-(1,1-dimethylethyl)-1-(3-methoxy-1-methylpropyl)- [ACD/Index Name]
N-{[1-(4-Methoxy-2-butanyl)-1,2,3-triazolidin-4-yl]methyl}-2-methyl-2-propanamin [German] [ACD/IUPAC Name]
N-{[1-(4-Methoxy-2-butanyl)-1,2,3-triazolidin-4-yl]methyl}-2-methyl-2-propanamine [ACD/IUPAC Name]
N-{[1-(4-Méthoxy-2-butanyl)-1,2,3-triazolidin-4-yl]méthyl}-2-méthyl-2-propanamine [French] [ACD/IUPAC Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 319.2±48.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.1±3.0 kJ/mol
Flash Point: 146.9±29.6 °C
Index of Refraction: 1.461
Molar Refractivity: 71.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 0.09
ACD/LogD (pH 5.5): -3.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.29
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 49 Å2
Polarizability: 28.2±0.5 10-24cm3
Surface Tension: 29.6±3.0 dyne/cm
Molar Volume: 259.3±3.0 cm3

Click to predict properties on the Chemicalize site






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