ChemSpider 2D Image | (2-Fluoro-4-methoxyphenyl)[1-(hydroxymethyl)-9-propyl-3,9-diazaspiro[5.5]undec-3-yl]methanone | C21H31FN2O3

(2-Fluoro-4-methoxyphenyl)[1-(hydroxymethyl)-9-propyl-3,9-diazaspiro[5.5]undec-3-yl]methanone

  • Molecular FormulaC21H31FN2O3
  • Average mass378.481 Da
  • Monoisotopic mass378.231873 Da
  • ChemSpider ID30948189

More details:

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

(2-Fluor-4-methoxyphenyl)[1-(hydroxymethyl)-9-propyl-3,9-diazaspiro[5.5]undec-3-yl]methanon [German] [ACD/IUPAC Name]
(2-Fluoro-4-methoxyphenyl)[1-(hydroxymethyl)-9-propyl-3,9-diazaspiro[5.5]undec-3-yl]methanone [ACD/IUPAC Name]
(2-Fluoro-4-méthoxyphényl)[1-(hydroxyméthyl)-9-propyl-3,9-diazaspiro[5.5]undéc-3-yl]méthanone [French] [ACD/IUPAC Name]
Methanone, (2-fluoro-4-methoxyphenyl)[1-(hydroxymethyl)-9-propyl-3,9-diazaspiro[5.5]undec-3-yl]- [ACD/Index Name]
[3-(2-fluoro-4-methoxybenzoyl)-9-propyl-3,9-diazaspiro[5.5]undec-1-yl]methanol

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

Density: 1.2±0.1 g/cm3
Boiling Point: 529.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.7±3.0 kJ/mol
Flash Point: 274.1±30.1 °C
Index of Refraction: 1.568
Molar Refractivity: 103.4±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.51
ACD/LogD (pH 5.5): -0.61
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.84
Polar Surface Area: 53 Å2
Polarizability: 41.0±0.5 10-24cm3
Surface Tension: 50.0±5.0 dyne/cm
Molar Volume: 316.2±5.0 cm3

Click to predict properties on the Chemicalize site


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