ChemSpider 2D Image | (6-Bromo-1H-indol-2-yl){4-[2-(trifluoromethyl)benzoyl]-1-piperazinyl}methanone | C21H17BrF3N3O2

(6-Bromo-1H-indol-2-yl){4-[2-(trifluoromethyl)benzoyl]-1-piperazinyl}methanone

  • Molecular FormulaC21H17BrF3N3O2
  • Average mass480.278 Da
  • Monoisotopic mass479.045624 Da
  • ChemSpider ID33695792

More details:

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

(6-Brom-1H-indol-2-yl){4-[2-(trifluormethyl)benzoyl]-1-piperazinyl}methanon [German] [ACD/IUPAC Name]
(6-Bromo-1H-indol-2-yl){4-[2-(trifluoromethyl)benzoyl]-1-piperazinyl}methanone [ACD/IUPAC Name]
(6-Bromo-1H-indol-2-yl){4-[2-(trifluorométhyl)benzoyl]-1-pipérazinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, (6-bromo-1H-indol-2-yl)[4-[2-(trifluoromethyl)benzoyl]-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 647.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 345.5±31.5 °C
Index of Refraction: 1.640
Molar Refractivity: 109.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 95.20
ACD/KOC (pH 5.5): 907.65
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 95.20
ACD/KOC (pH 7.4): 907.65
Polar Surface Area: 56 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 304.7±3.0 cm3

Click to predict properties on the Chemicalize site


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