ChemSpider 2D Image | 1-(2,2-Dimethoxyethyl)-4-(3-fluoro-2-pyridinyl)-1,4-diazepane | C14H22FN3O2

1-(2,2-Dimethoxyethyl)-4-(3-fluoro-2-pyridinyl)-1,4-diazepane

  • Molecular FormulaC14H22FN3O2
  • Average mass283.342 Da
  • Monoisotopic mass283.169617 Da
  • ChemSpider ID35189075

More details:






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

1-(2,2-Dimethoxyethyl)-4-(3-fluor-2-pyridinyl)-1,4-diazepan [German] [ACD/IUPAC Name]
1-(2,2-Dimethoxyethyl)-4-(3-fluoro-2-pyridinyl)-1,4-diazepane [ACD/IUPAC Name]
1-(2,2-Diméthoxyéthyl)-4-(3-fluoro-2-pyridinyl)-1,4-diazépane [French] [ACD/IUPAC Name]
1H-1,4-Diazepine, 1-(2,2-dimethoxyethyl)-4-(3-fluoro-2-pyridinyl)hexahydro- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 359.4±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 171.2±27.9 °C
Index of Refraction: 1.506
Molar Refractivity: 74.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.50
ACD/LogD (pH 5.5): -1.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.85
ACD/BCF (pH 7.4): 1.89
ACD/KOC (pH 7.4): 38.11
Polar Surface Area: 38 Å2
Polarizability: 29.6±0.5 10-24cm3
Surface Tension: 39.0±3.0 dyne/cm
Molar Volume: 251.6±3.0 cm3

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