ChemSpider 2D Image | 1-(2-Fluorocyclohexyl)-1,4-diazepane | C11H21FN2

1-(2-Fluorocyclohexyl)-1,4-diazepane

  • Molecular FormulaC11H21FN2
  • Average mass200.296 Da
  • Monoisotopic mass200.168884 Da
  • ChemSpider ID110764927

More details:

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

1-(2-Fluorcyclohexyl)-1,4-diazepan [German] [ACD/IUPAC Name]
1-(2-Fluorocyclohexyl)-1,4-diazepane [ACD/IUPAC Name]
1-(2-Fluorocyclohexyl)-1,4-diazépane [French] [ACD/IUPAC Name]
1H-1,4-Diazepine, 1-(2-fluorocyclohexyl)hexahydro- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 280.2±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.9±3.0 kJ/mol
Flash Point: 123.2±27.3 °C
Index of Refraction: 1.495
Molar Refractivity: 56.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.53
ACD/LogD (pH 5.5): -2.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.04
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 15 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 35.1±5.0 dyne/cm
Molar Volume: 193.6±5.0 cm3

Click to predict properties on the Chemicalize site


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