Found 1 result

Search term: PCKCKKZVKGXAAO (Found by InChIKey (skeleton match))

ChemSpider 2D Image | 9-(4-Fluoro-3-methylbenzyl)-3-oxa-9-azaspiro[5.5]undecane | C17H24FNO

9-(4-Fluoro-3-methylbenzyl)-3-oxa-9-azaspiro[5.5]undecane

  • Molecular FormulaC17H24FNO
  • Average mass277.377 Da
  • Monoisotopic mass277.184204 Da
  • ChemSpider ID30943839

More details:






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

3-Oxa-9-azaspiro[5.5]undecane, 9-[(4-fluoro-3-methylphenyl)methyl]- [ACD/Index Name]
9-(4-Fluor-3-methylbenzyl)-3-oxa-9-azaspiro[5.5]undecan [German] [ACD/IUPAC Name]
9-(4-Fluoro-3-methylbenzyl)-3-oxa-9-azaspiro[5.5]undecane [ACD/IUPAC Name]
9-(4-Fluoro-3-méthylbenzyl)-3-oxa-9-azaspiro[5.5]undécane [French] [ACD/IUPAC Name]
9-[(4-FLUORO-3-METHYLPHENYL)METHYL]-3-OXA-9-AZASPIRO[5.5]UNDECANE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.1±0.1 g/cm3
Boiling Point: 374.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 180.2±27.9 °C
Index of Refraction: 1.547
Molar Refractivity: 79.3±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 0.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.14
ACD/LogD (pH 7.4): 1.88
ACD/BCF (pH 7.4): 6.33
ACD/KOC (pH 7.4): 44.12
Polar Surface Area: 12 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 41.2±5.0 dyne/cm
Molar Volume: 250.2±5.0 cm3

Click to predict properties on the Chemicalize site






Advertisement