ChemSpider 2D Image | N-[(3-Phenyl-1H-1,2,4-triazol-5-yl)methyl]-1,3,5-triazin-2-amine | C12H11N7

N-[(3-Phenyl-1H-1,2,4-triazol-5-yl)methyl]-1,3,5-triazin-2-amine

  • Molecular FormulaC12H11N7
  • Average mass253.263 Da
  • Monoisotopic mass253.107590 Da
  • ChemSpider ID35051452

More details:

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

1,3,5-Triazin-2-amine, N-[(3-phenyl-1H-1,2,4-triazol-5-yl)methyl]- [ACD/Index Name]
N-[(3-Phenyl-1H-1,2,4-triazol-5-yl)methyl]-1,3,5-triazin-2-amin [German] [ACD/IUPAC Name]
N-[(3-Phenyl-1H-1,2,4-triazol-5-yl)methyl]-1,3,5-triazin-2-amine [ACD/IUPAC Name]
N-[(3-Phényl-1H-1,2,4-triazol-5-yl)méthyl]-1,3,5-triazin-2-amine [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: 576.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.3±3.0 kJ/mol
Flash Point: 302.2±32.9 °C
Index of Refraction: 1.707
Molar Refractivity: 69.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.08
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.06
ACD/KOC (pH 5.5): 77.36
ACD/LogD (pH 7.4): 0.94
ACD/BCF (pH 7.4): 3.06
ACD/KOC (pH 7.4): 77.32
Polar Surface Area: 92 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 83.5±3.0 dyne/cm
Molar Volume: 179.3±3.0 cm3

Click to predict properties on the Chemicalize site


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