ChemSpider 2D Image | (2,2-Dichlorocyclopropyl)[4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]methanone | C18H17Cl2F3N4O2

(2,2-Dichlorocyclopropyl)[4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]methanone

  • Molecular FormulaC18H17Cl2F3N4O2
  • Average mass449.254 Da
  • Monoisotopic mass448.068054 Da
  • ChemSpider ID31567158

More details:

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

(2,2-Dichlorcyclopropyl)[4-({3-[3-(trifluormethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(2,2-Dichlorocyclopropyl)[4-({3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl}methyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(2,2-Dichlorocyclopropyl)[4-({3-[3-(trifluorométhyl)phényl]-1,2,4-oxadiazol-5-yl}méthyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (2,2-dichlorocyclopropyl)[4-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 575.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 301.7±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 99.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 299.47
ACD/KOC (pH 5.5): 2060.56
ACD/LogD (pH 7.4): 3.56
ACD/BCF (pH 7.4): 299.93
ACD/KOC (pH 7.4): 2063.76
Polar Surface Area: 62 Å2
Polarizability: 39.5±0.5 10-24cm3
Surface Tension: 60.9±5.0 dyne/cm
Molar Volume: 291.9±5.0 cm3

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