XLR-11 C21H28FNO structure – Flashcards

Flashcard maker : Briley Leonard

Molecular Formula C21H28FNO
Average mass 329.452 Da
Density 1.1±0.1 g/cm3
Boiling Point 442.0±25.0 °C at 760 mmHg
Flash Point 221.1±23.2 °C
Molar Refractivity 96.7±0.5 cm3
Polarizability 38.3±0.5 10-24cm3
Surface Tension 35.5±7.0 dyne/cm
Molar Volume 303.3±7.0 cm3
  • Experimental data
  • Predicted – ACD/Labs
  • Predicted – ChemAxon
  • Miscellaneous
    • Safety:

      IRRITANT Matrix Scientific 100440

Predicted data is generated using the ACD/Labs Percepta Platform – PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 442.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 221.1±23.2 °C
Index of Refraction: 1.550
Molar Refractivity: 96.7±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.35
ACD/LogD (pH 5.5): 5.55
ACD/BCF (pH 5.5): 9672.19
ACD/KOC (pH 5.5): 24798.66
ACD/LogD (pH 7.4): 5.55
ACD/BCF (pH 7.4): 9672.19
ACD/KOC (pH 7.4): 24798.66
Polar Surface Area: 22 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 35.5±7.0 dyne/cm
Molar Volume: 303.3±7.0 cm3

Click to predict properties on the Chemicalize site

Get an explanation on any task
Get unstuck with the help of our AI assistant in seconds
New