ChemSpider 2D Image | 4-Chloro-6-[(1-methyl-1H-1,2,4-triazol-3-yl)oxy]-1,3,5-triazin-2-amine | C6H6ClN7O

4-Chloro-6-[(1-methyl-1H-1,2,4-triazol-3-yl)oxy]-1,3,5-triazin-2-amine

  • Molecular FormulaC6H6ClN7O
  • Average mass227.611 Da
  • Monoisotopic mass227.032242 Da
  • ChemSpider ID53080086

More details:

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

1,3,5-Triazin-2-amine, 4-chloro-6-[(1-methyl-1H-1,2,4-triazol-3-yl)oxy]- [ACD/Index Name]
4-Chlor-6-[(1-methyl-1H-1,2,4-triazol-3-yl)oxy]-1,3,5-triazin-2-amin [German] [ACD/IUPAC Name]
4-Chloro-6-[(1-methyl-1H-1,2,4-triazol-3-yl)oxy]-1,3,5-triazin-2-amine [ACD/IUPAC Name]
4-Chloro-6-[(1-méthyl-1H-1,2,4-triazol-3-yl)oxy]-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: 1.9±0.1 g/cm3
Boiling Point: 551.7±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.2±3.0 kJ/mol
Flash Point: 287.4±25.4 °C
Index of Refraction: 1.832
Molar Refractivity: 52.0±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -0.52
ACD/LogD (pH 5.5): -0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 19.35
ACD/LogD (pH 7.4): -0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 19.37
Polar Surface Area: 105 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 83.0±7.0 dyne/cm
Molar Volume: 118.3±7.0 cm3

Click to predict properties on the Chemicalize site


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