ChemSpider 2D Image | 1-Cyclopropyl-6-fluoro-4-oxo-7-[(4-~2~H)-1-piperazinyl]-1,4-dihydro-3-quinoline(~2~H)carboxylic acid | C17H16D2FN3O3

1-Cyclopropyl-6-fluoro-4-oxo-7-[(4-2H)-1-piperazinyl]-1,4-dihydro-3-quinoline(2H)carboxylic acid

  • Molecular FormulaC17H16D2FN3O3
  • Average mass333.354 Da
  • Monoisotopic mass333.145782 Da
  • ChemSpider ID95712947
  • Non-standard isotope - Non-standard isotope


More details:






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

1-Cyclopropyl-6-fluor-4-oxo-7-[(4-2H)-1-piperazinyl]-1,4-dihydro-3-chinolin(2H)carbonsäure [German] [ACD/IUPAC Name]
1-Cyclopropyl-6-fluoro-4-oxo-7-[(4-2H)-1-piperazinyl]-1,4-dihydro-3-quinoline(2H)carboxylic acid [ACD/IUPAC Name]
3-Quinolinecarboxylic acid-d, 1-cyclopropyl-6-fluoro-1,4-dihydro-4-oxo-7-(1-piperazinyl-4-d)- [ACD/Index Name]
Acide 1-cyclopropyl-6-fluoro-4-oxo-7-[(4-2H)-1-pipérazinyl]-1,4-dihydro-3-quinoléine(2H)carboxylique [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 581.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.5±3.0 kJ/mol
Flash Point: 305.6±30.1 °C
Index of Refraction: 1.655
Molar Refractivity: 83.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.65
ACD/LogD (pH 5.5): -2.98
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 33.0±0.5 10-24cm3
Surface Tension: 67.4±3.0 dyne/cm
Molar Volume: 226.8±3.0 cm3

Click to predict properties on the Chemicalize site






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