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Search term: NFYJVUPADUMVIG-UXHLAJHPSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Methyl 2-({(E)-[5,7-difluoro-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-2,3-dihydro-4(1H)-quinolinylidene]amino}oxy)-2-methylpropanoate | C25H27F2N3O3

Methyl 2-({(E)-[5,7-difluoro-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-2,3-dihydro-4(1H)-quinolinylidene]amino}oxy)-2-methylpropanoate

  • Molecular FormulaC25H27F2N3O3
  • Average mass455.497 Da
  • Monoisotopic mass455.202057 Da
  • ChemSpider ID26348268

  • Double-bond stereo - Double-bond stereo

More details:

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

2-({(E)-[5,7-Difluoro-2,2-diméthyl-6-(3-méthyl-1H-indol-7-yl)-2,3-dihydro-4(1H)-quinoléinylidène]amino}oxy)-2-méthylpropanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-({(E)-[5,7-difluoro-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-2,3-dihydro-4(1H)-quinolinylidene]amino}oxy)-2-methylpropanoate [ACD/IUPAC Name]
Methyl-2-({(E)-[5,7-difluor-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-2,3-dihydro-4(1H)-chinolinyliden]amino}oxy)-2-methylpropanoat [German] [ACD/IUPAC Name]
Propanoic acid, 2-[[[(4E)-5,7-difluoro-2,3-dihydro-2,2-dimethyl-6-(3-methyl-1H-indol-7-yl)-4(1H)-quinolinylidene]amino]oxy]-2-methyl-, methyl ester [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 560.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.4±32.9 °C
Index of Refraction: 1.589
Molar Refractivity: 120.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 7.20
ACD/LogD (pH 5.5): 6.57
ACD/BCF (pH 5.5): 58166.35
ACD/KOC (pH 5.5): 89539.85
ACD/LogD (pH 7.4): 6.57
ACD/BCF (pH 7.4): 58220.98
ACD/KOC (pH 7.4): 89623.95
Polar Surface Area: 76 Å2
Polarizability: 47.6±0.5 10-24cm3
Surface Tension: 38.7±7.0 dyne/cm
Molar Volume: 356.3±7.0 cm3

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