ChemSpider 2D Image | 3,5-Bis(trifluoromethyl)-N-{4-[4-(9H-xanthen-9-ylcarbonyl)-1-piperazinyl]phenyl}benzamide | C33H25F6N3O3

3,5-Bis(trifluoromethyl)-N-{4-[4-(9H-xanthen-9-ylcarbonyl)-1-piperazinyl]phenyl}benzamide

  • Molecular FormulaC33H25F6N3O3
  • Average mass625.560 Da
  • Monoisotopic mass625.179993 Da
  • ChemSpider ID3840694

More details:

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

3,5-Bis(trifluormethyl)-N-{4-[4-(9H-xanthen-9-ylcarbonyl)-1-piperazinyl]phenyl}benzamid [German] [ACD/IUPAC Name]
3,5-Bis(trifluoromethyl)-N-{4-[4-(9H-xanthen-9-ylcarbonyl)-1-piperazinyl]phenyl}benzamide [ACD/IUPAC Name]
3,5-Bis(trifluorométhyl)-N-{4-[4-(9H-xanthén-9-ylcarbonyl)-1-pipérazinyl]phényl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-bis(trifluoromethyl)-N-[4-[4-(9H-xanthen-9-ylcarbonyl)-1-piperazinyl]phenyl]- [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: 642.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.4±31.5 °C
Index of Refraction: 1.605
Molar Refractivity: 152.5±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 6.52
ACD/BCF (pH 5.5): 52755.20
ACD/KOC (pH 5.5): 83331.88
ACD/LogD (pH 7.4): 6.52
ACD/BCF (pH 7.4): 53165.08
ACD/KOC (pH 7.4): 83979.33
Polar Surface Area: 62 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 443.1±3.0 cm3

Click to predict properties on the Chemicalize site


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