ChemSpider 2D Image | XLR11 N-(2-fluoropentyl) isomer | C21H28FNO

XLR11 N-(2-fluoropentyl) isomer

  • Molecular FormulaC21H28FNO
  • Average mass329.452 Da
  • Monoisotopic mass329.215485 Da
  • ChemSpider ID29341390

More details:

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

[1-(2-Fluoropentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanone [ACD/IUPAC Name]
[1-(2-Fluoropentyl)-1H-indol-3-yl](2,2,3,3-tétraméthylcyclopropyl)méthanone [French] [ACD/IUPAC Name]
[1-(2-Fluorpentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)methanon [German] [ACD/IUPAC Name]
1628690-25-4 [RN]
Methanone, [1-(2-fluoropentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)- [ACD/Index Name]
XLR11 N-(2-fluoropentyl) isomer
(1-(2-fluoropentyl)-1H-indol-3-yl)(2,2,3,3-tetramethylcyclopropyl)methanone
[1-(2-fluoropentyl)-1H-indol-3-yl](2,2,3,3-tetramethylcyclopropyl)-methanone
[1-(2-fluoropentyl)indol-3-yl]-(2,2,3,3-tetramethylcyclopropyl)methanone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 435.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.2±3.0 kJ/mol
Flash Point: 217.0±23.2 °C
Index of Refraction: 1.551
Molar Refractivity: 96.5±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.64
ACD/LogD (pH 5.5): 5.66
ACD/BCF (pH 5.5): 11757.96
ACD/KOC (pH 5.5): 28518.88
ACD/LogD (pH 7.4): 5.66
ACD/BCF (pH 7.4): 11757.96
ACD/KOC (pH 7.4): 28518.88
Polar Surface Area: 22 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 34.5±7.0 dyne/cm
Molar Volume: 302.4±7.0 cm3

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