ChemSpider 2D Image | 5-[3-(Methylamino)propyl]-1,2,4-triazolidine-3,4-diamine | C6H18N6

5-[3-(Methylamino)propyl]-1,2,4-triazolidine-3,4-diamine

  • Molecular FormulaC6H18N6
  • Average mass174.247 Da
  • Monoisotopic mass174.159302 Da
  • ChemSpider ID111771060

More details:

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

1,2,4-Triazolidine-3,4-diamine, 5-[3-(methylamino)propyl]- [ACD/Index Name]
5-[3-(Methylamino)propyl]-1,2,4-triazolidin-3,4-diamin [German] [ACD/IUPAC Name]
5-[3-(Methylamino)propyl]-1,2,4-triazolidine-3,4-diamine [ACD/IUPAC Name]
5-[3-(Méthylamino)propyl]-1,2,4-triazolidine-3,4-diamine [French] [ACD/IUPAC Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 283.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.2±3.0 kJ/mol
Flash Point: 125.0±27.3 °C
Index of Refraction: 1.498
Molar Refractivity: 48.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 7
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -3.19
ACD/LogD (pH 5.5): -6.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -6.61
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 91 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 35.9±3.0 dyne/cm
Molar Volume: 166.4±3.0 cm3

Click to predict properties on the Chemicalize site


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