ChemSpider 2D Image | 1,3-bis(2-fluorophenyl)-5-propyl-1,3,5-triazinane | C18H21F2N3

1,3-bis(2-fluorophenyl)-5-propyl-1,3,5-triazinane

  • Molecular FormulaC18H21F2N3
  • Average mass317.376 Da
  • Monoisotopic mass317.170349 Da
  • ChemSpider ID21127226

More details:

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

1,3-Bis(2-fluorophényl)-5-propyl-1,3,5-triazinane [French] [ACD/IUPAC Name]
1,3-Bis(2-fluorphenyl)-5-propyl-1,3,5-triazinan [German] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 418.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.2±3.0 kJ/mol
Flash Point: 206.7±28.7 °C
Index of Refraction: 1.559
Molar Refractivity: 87.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 169.92
ACD/KOC (pH 5.5): 1115.66
ACD/LogD (pH 7.4): 3.65
ACD/BCF (pH 7.4): 348.93
ACD/KOC (pH 7.4): 2291.00
Polar Surface Area: 10 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 270.5±3.0 cm3

Click to predict properties on the Chemicalize site


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