ChemSpider 2D Image | 3-Cyclopropyl-1-(2-fluoroethyl)-7-methyl-1,4-diazepane | C11H21FN2

3-Cyclopropyl-1-(2-fluoroethyl)-7-methyl-1,4-diazepane

  • Molecular FormulaC11H21FN2
  • Average mass200.296 Da
  • Monoisotopic mass200.168884 Da
  • ChemSpider ID36334195

More details:

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

1H-1,4-Diazepine, 3-cyclopropyl-1-(2-fluoroethyl)hexahydro-7-methyl- [ACD/Index Name]
3-Cyclopropyl-1-(2-fluorethyl)-7-methyl-1,4-diazepan [German] [ACD/IUPAC Name]
3-Cyclopropyl-1-(2-fluoroethyl)-7-methyl-1,4-diazepane [ACD/IUPAC Name]
3-Cyclopropyl-1-(2-fluoroéthyl)-7-méthyl-1,4-diazépane [French] [ACD/IUPAC Name]
1516013-94-7 [RN]
MFCD23972469

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

Density: 1.0±0.1 g/cm3
Boiling Point: 268.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 50.6±3.0 kJ/mol
Flash Point: 116.0±24.6 °C
Index of Refraction: 1.469
Molar Refractivity: 56.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.90
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 15 Å2
Polarizability: 22.2±0.5 10-24cm3
Surface Tension: 29.6±3.0 dyne/cm
Molar Volume: 201.2±3.0 cm3

Click to predict properties on the Chemicalize site


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