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Search term: UBWJUXGEJRJLRS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | [{2-[(E)-2-{8-[Bis(carboxymethyl)amino]-6-methoxy-2-quinolinyl}vinyl]phenyl}(carboxymethyl)amino]acetic acid | C26H25N3O9

[{2-[(E)-2-{8-[Bis(carboxymethyl)amino]-6-methoxy-2-quinolinyl}vinyl]phenyl}(carboxymethyl)amino]acetic acid

  • Molecular FormulaC26H25N3O9
  • Average mass523.491 Da
  • Monoisotopic mass523.159058 Da
  • ChemSpider ID4943460

  • Double-bond stereo - Double-bond stereo

More details:

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

[{2-[(E)-2-{8-[Bis(carboxymethyl)amino]-6-methoxy-2-chinolinyl}vinyl]phenyl}(carboxymethyl)amino]essigsäure [German] [ACD/IUPAC Name]
[{2-[(E)-2-{8-[Bis(carboxymethyl)amino]-6-methoxy-2-quinolinyl}vinyl]phenyl}(carboxymethyl)amino]acetic acid [ACD/IUPAC Name]
Acide [{2-[(E)-2-{8-[bis(carboxyméthyl)amino]-6-méthoxy-2-quinoléinyl}vinyl]phényl}(carboxyméthyl)amino]acétique [French] [ACD/IUPAC Name]
(E)-2,2'-((2-(2-(8-(Bis(carboxymethyl)amino)-6-methoxyquinolin-2-yl)vinyl)phenyl)azanediyl)diacetic acid
8-(bis(ethoxycarbonylmethyl)amino)-6-methoxy-2-(bis(ethoxycarbonylmethyl)amino)styrylquinoline
86277-62-5 [RN]
Glycine, N-(2-(2-(8-(bis(carboxymethyl)amino)-6-methoxy-2-quinolinyl)ethenyl)phenyl)-N-(carboxymethyl)-, (E)-
Quene 1

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

Density: 1.5±0.1 g/cm3
Boiling Point: 839.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 127.9±3.0 kJ/mol
Flash Point: 461.7±34.3 °C
Index of Refraction: 1.745
Molar Refractivity: 139.7±0.3 cm3
#H bond acceptors: 12
#H bond donors: 4
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 1.83
ACD/LogD (pH 5.5): -4.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -5.00
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 178 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 85.3±3.0 dyne/cm
Molar Volume: 344.5±3.0 cm3

Click to predict properties on the Chemicalize site


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