ChemSpider 2D Image | 4-Amino-6-(pentafluoroethyl)-1,3,5-triazin-2(5H)-one | C5H3F5N4O

4-Amino-6-(pentafluoroethyl)-1,3,5-triazin-2(5H)-one

  • Molecular FormulaC5H3F5N4O
  • Average mass230.096 Da
  • Monoisotopic mass230.022705 Da
  • ChemSpider ID51089151

More details:

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

1,3,5-Triazin-2(5H)-one, 4-amino-6-(1,1,2,2,2-pentafluoroethyl)- [ACD/Index Name]
4-Amino-6-(pentafluorethyl)-1,3,5-triazin-2(5H)-on [German] [ACD/IUPAC Name]
4-Amino-6-(pentafluoroethyl)-1,3,5-triazin-2(5H)-one [ACD/IUPAC Name]
4-Amino-6-(pentafluoroéthyl)-1,3,5-triazin-2(5H)-one [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: 184.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.7±0.4 mmHg at 25°C
Enthalpy of Vaporization: 42.1±3.0 kJ/mol
Flash Point: 65.4±30.1 °C
Index of Refraction: 1.511
Molar Refractivity: 35.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.62
ACD/LogD (pH 5.5): -0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.34
ACD/LogD (pH 7.4): -1.64
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 80 Å2
Polarizability: 14.0±0.5 10-24cm3
Surface Tension: 39.1±7.0 dyne/cm
Molar Volume: 118.1±7.0 cm3

Click to predict properties on the Chemicalize site


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