Found 185 results

Search term: MF = 'C_{21}H_{20}ClF_{3}N_{2}O_{4}'
ChemSpider 2D Image | (8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl){4-[4-(trifluoromethoxy)benzyl]-1-piperazinyl}methanone | C21H20ClF3N2O4

(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl){4-[4-(trifluoromethoxy)benzyl]-1-piperazinyl}methanone

  • Molecular FormulaC21H20ClF3N2O4
  • Average mass456.843 Da
  • Monoisotopic mass456.106354 Da
  • ChemSpider ID30522168

More details:

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

(8-Chlor-2,3-dihydro-1,4-benzodioxin-6-yl){4-[4-(trifluormethoxy)benzyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl){4-[4-(trifluoromethoxy)benzyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
(8-Chloro-2,3-dihydro-1,4-benzodioxin-6-yl){4-[4-(trifluorométhoxy)benzyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, (8-chloro-2,3-dihydro-1,4-benzodioxin-6-yl)[4-[[4-(trifluoromethoxy)phenyl]methyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 546.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.5±3.0 kJ/mol
Flash Point: 284.0±30.1 °C
Index of Refraction: 1.573
Molar Refractivity: 107.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 186.81
ACD/KOC (pH 5.5): 1086.74
ACD/LogD (pH 7.4): 3.89
ACD/BCF (pH 7.4): 528.76
ACD/KOC (pH 7.4): 3076.02
Polar Surface Area: 51 Å2
Polarizability: 42.5±0.5 10-24cm3
Surface Tension: 47.5±3.0 dyne/cm
Molar Volume: 325.2±3.0 cm3

Click to predict properties on the Chemicalize site


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