ChemSpider 2D Image | (1-{[5-(Methoxymethyl)-2-furyl]methyl}-3-piperidinyl)[4-(trifluoromethyl)phenyl]methanone | C20H22F3NO3

(1-{[5-(Methoxymethyl)-2-furyl]methyl}-3-piperidinyl)[4-(trifluoromethyl)phenyl]methanone

  • Molecular FormulaC20H22F3NO3
  • Average mass381.389 Da
  • Monoisotopic mass381.155182 Da
  • ChemSpider ID22214918

More details:

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

(1-{[5-(Methoxymethyl)-2-furyl]methyl}-3-piperidinyl)[4-(trifluormethyl)phenyl]methanon [German] [ACD/IUPAC Name]
(1-{[5-(Methoxymethyl)-2-furyl]methyl}-3-piperidinyl)[4-(trifluoromethyl)phenyl]methanone [ACD/IUPAC Name]
(1-{[5-(Méthoxyméthyl)-2-furyl]méthyl}-3-pipéridinyl)[4-(trifluorométhyl)phényl]méthanone [French] [ACD/IUPAC Name]
Methanone, [1-[[5-(methoxymethyl)-2-furanyl]methyl]-3-piperidinyl][4-(trifluoromethyl)phenyl]- [ACD/Index Name]
1-{[5-(METHOXYMETHYL)FURAN-2-YL]METHYL}-3-[4-(TRIFLUOROMETHYL)BENZOYL]PIPERIDINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 436.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 217.8±28.7 °C
Index of Refraction: 1.522
Molar Refractivity: 94.0±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.60
ACD/LogD (pH 5.5): 1.96
ACD/BCF (pH 5.5): 6.78
ACD/KOC (pH 5.5): 43.01
ACD/LogD (pH 7.4): 3.48
ACD/BCF (pH 7.4): 226.31
ACD/KOC (pH 7.4): 1435.88
Polar Surface Area: 43 Å2
Polarizability: 37.3±0.5 10-24cm3
Surface Tension: 39.7±3.0 dyne/cm
Molar Volume: 308.3±3.0 cm3

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