ChemSpider 2D Image | FUB-PB-22 | C25H17FN2O2

FUB-PB-22

  • Molecular FormulaC25H17FN2O2
  • Average mass396.413 Da
  • Monoisotopic mass396.127411 Da
  • ChemSpider ID29763736

More details:






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

1-(4-Fluorobenzyl)-1H-indole-3-carboxylate de 8-quinoléinyle [French] [ACD/IUPAC Name]
1800098-36-5 [RN]
1H-Indole-3-carboxylic acid, 1-[(4-fluorophenyl)methyl]-, 8-quinolinyl ester [ACD/Index Name]
8-Chinolinyl-1-(4-fluorbenzyl)-1H-indol-3-carboxylat [German] [ACD/IUPAC Name]
8-Quinolinyl 1-(4-fluorobenzyl)-1H-indole-3-carboxylate [ACD/IUPAC Name]
DS46154N3F
FUB-PB-22
QUFUBIC [Wiki]
1-[(4-fluorophenyl)methyl]-1H-indole-3-carboxylic acid, 8-quinolinyl ester
quinolin-8-yl-1-(4-fluorobenzyl)-1H-indole-3-carboxylate
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 621.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.7±28.7 °C
Index of Refraction: 1.646
Molar Refractivity: 114.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.38
ACD/LogD (pH 5.5): 5.00
ACD/BCF (pH 5.5): 3732.89
ACD/KOC (pH 5.5): 12543.02
ACD/LogD (pH 7.4): 5.00
ACD/BCF (pH 7.4): 3734.72
ACD/KOC (pH 7.4): 12549.17
Polar Surface Area: 44 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 47.3±7.0 dyne/cm
Molar Volume: 314.4±7.0 cm3

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