ChemSpider 2D Image | 2-(3-Nitro-1H-1,2,4-triazol-1-yl)-N-[2-(propylamino)ethyl]acetamide | C9H16N6O3

2-(3-Nitro-1H-1,2,4-triazol-1-yl)-N-[2-(propylamino)ethyl]acetamide

  • Molecular FormulaC9H16N6O3
  • Average mass256.262 Da
  • Monoisotopic mass256.128387 Da
  • ChemSpider ID63687692

More details:

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

1H-1,2,4-Triazole-1-acetamide, 3-nitro-N-[2-(propylamino)ethyl]- [ACD/Index Name]
2-(3-Nitro-1H-1,2,4-triazol-1-yl)-N-[2-(propylamino)ethyl]acetamid [German] [ACD/IUPAC Name]
2-(3-Nitro-1H-1,2,4-triazol-1-yl)-N-[2-(propylamino)ethyl]acetamide [ACD/IUPAC Name]
2-(3-Nitro-1H-1,2,4-triazol-1-yl)-N-[2-(propylamino)éthyl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.627
Molar Refractivity: 64.0±0.5 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.05
ACD/LogD (pH 5.5): -3.38
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.18
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 118 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 60.7±7.0 dyne/cm
Molar Volume: 180.5±7.0 cm3

Click to predict properties on the Chemicalize site


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