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Search term: YOXJXZQOMVTVFS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | {[2-({2-[Bis(carboxymethyl)amino]-5-fluoro-4-methylphenoxy}methyl)-8-quinolinyl](carboxymethyl)amino}acetic acid | C25H24FN3O9

{[2-({2-[Bis(carboxymethyl)amino]-5-fluoro-4-methylphenoxy}methyl)-8-quinolinyl](carboxymethyl)amino}acetic acid

  • Molecular FormulaC25H24FN3O9
  • Average mass529.471 Da
  • Monoisotopic mass529.149658 Da
  • ChemSpider ID115826

More details:

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

{[2-({2-[Bis(carboxymethyl)amino]-5-fluoro-4-methylphenoxy}methyl)-8-quinolinyl](carboxymethyl)amino}acetic acid [ACD/IUPAC Name]
{[2-({8-[Bis(carboxymethyl)amino]-2-chinolinyl}methoxy)-4-fluor-5-methylphenyl](carboxymethyl)amino}essigsäure [German] [ACD/IUPAC Name]
Acide {[2-({2-[bis(carboxyméthyl)amino]-5-fluoro-4-méthylphénoxy}méthyl)-8-quinoléinyl](carboxyméthyl)amino}acétique [French] [ACD/IUPAC Name]
109024-53-5 [RN]
2-(2-Amino-4-methyl-5-fluorophenoxy)methyl-8-aminoquinoline-N,N,N',N'-tetraacetic acid
Glycine, N-(2-((2-(bis(carboxymethyl)amino)-5-fluoro-4-methylphenoxy)methyl)-8-quinolinyl)-N-(carboxymethyl)-
Glycine,N-[2-[[2-[bis(carboxymethyl)amino]-5-fluoro-4-methylphenoxy]methyl]-8-quinolinyl]-N-(carboxymethyl)-
Quinmf
Quin-MF

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

Density: 1.5±0.1 g/cm3
Boiling Point: 811.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 123.7±3.0 kJ/mol
Flash Point: 444.5±34.3 °C
Index of Refraction: 1.695
Molar Refractivity: 131.6±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 1.20
ACD/LogD (pH 5.5): -4.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.22
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 178 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 81.6±3.0 dyne/cm
Molar Volume: 342.5±3.0 cm3

Click to predict properties on the Chemicalize site


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