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Search term: QIOQMBMMFJWPLR (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-(2-Fluorophenyl)-N-[6-(methylsulfanyl)hexyl]cyclobutanamine | C17H26FNS

3-(2-Fluorophenyl)-N-[6-(methylsulfanyl)hexyl]cyclobutanamine

  • Molecular FormulaC17H26FNS
  • Average mass295.458 Da
  • Monoisotopic mass295.177002 Da
  • ChemSpider ID50522729

More details:

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

3-(2-Fluorophenyl)-N-[6-(methylsulfanyl)hexyl]cyclobutanamine [ACD/IUPAC Name]
3-(2-Fluorophényl)-N-[6-(méthylsulfanyl)hexyl]cyclobutanamine [French] [ACD/IUPAC Name]
3-(2-Fluorphenyl)-N-[6-(methylsulfanyl)hexyl]cyclobutanamin [German] [ACD/IUPAC Name]
Cyclobutanamine, 3-(2-fluorophenyl)-N-[6-(methylthio)hexyl]- [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: 390.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 189.9±27.9 °C
Index of Refraction: 1.538
Molar Refractivity: 87.4±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.54
ACD/LogD (pH 7.4): 1.26
ACD/BCF (pH 7.4): 1.08
ACD/KOC (pH 7.4): 5.51
Polar Surface Area: 37 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 39.3±5.0 dyne/cm
Molar Volume: 279.2±5.0 cm3

Click to predict properties on the Chemicalize site


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