ChemSpider 2D Image | MFCD15071267 | C1713CH17D3FN3O4


  • Molecular FormulaC1713CH17D3FN3O4
  • Average mass365.379 Da
  • Monoisotopic mass365.165955 Da
  • ChemSpider ID49073443
  • defined stereocentres - 1 of 1 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(3S)-9-Fluor-3-methyl-10-[4-(13C,2H3)methyl-1-piperazinyl]-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]chinolin-6-carbonsäure [German] [ACD/IUPAC Name]
(3S)-9-Fluoro-3-methyl-10-[4-(13C,2H3)methyl-1-piperazinyl]-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid [ACD/IUPAC Name]
1261398-33-7 [RN]
7H-1,4-Oxazino[2,3,4-ij]quinoline-6-carboxylic acid, 9-fluoro-2,3-dihydro-3-methyl-10-[4-(methyl-13C-d3)-1-piperazinyl]-7-oxo-, (3S)- [ACD/Index Name]
Acide (3S)-9-fluoro-3-méthyl-10-[4-(13C,2H3)méthyl-1-pipérazinyl]-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoléine-6-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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.670
Molar Refractivity: 91.1±0.4 cm3
#H bond acceptors:
#H bond donors:
#Freely Rotating Bonds:
#Rule of 5 Violations:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area:
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 70.3±5.0 dyne/cm
Molar Volume: 244.0±5.0 cm3

Click to predict properties on the Chemicalize site