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Search term: MXRNEZXMCIDZEM-AWQFTUOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | [5-Hydroxy-4-({(E)-[(4-hydroxy-2,2'-bipyridin-6-yl)methylene]amino}methyl)-6-methyl-3-pyridinyl]methyl dihydrogen phosphate | C19H19N4O6P

[5-Hydroxy-4-({(E)-[(4-hydroxy-2,2'-bipyridin-6-yl)methylene]amino}methyl)-6-methyl-3-pyridinyl]methyl dihydrogen phosphate

  • Molecular FormulaC19H19N4O6P
  • Average mass430.351 Da
  • Monoisotopic mass430.104218 Da
  • ChemSpider ID59052108

  • Double-bond stereo - Double-bond stereo

More details:

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

[5-Hydroxy-4-({(E)-[(4-hydroxy-2,2'-bipyridin-6-yl)methylen]amino}methyl)-6-methyl-3-pyridinyl]methyldihydrogenphosphat [German] [ACD/IUPAC Name]
[5-Hydroxy-4-({(E)-[(4-hydroxy-2,2'-bipyridin-6-yl)methylene]amino}methyl)-6-methyl-3-pyridinyl]methyl dihydrogen phosphate [ACD/IUPAC Name]
3-Pyridinemethanol, 5-hydroxy-4-[[[(1E)-(4-hydroxy[2,2'-bipyridin]-6-yl)methylene]amino]methyl]-6-methyl-, α-(dihydrogen phosphate) [ACD/Index Name]
Dihydrogénophosphate de [5-hydroxy-4-({(E)-[(4-hydroxy-2,2'-bipyridin-6-yl)méthylène]amino}méthyl)-6-méthyl-3-pyridinyl]méthyle [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 884.6±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.7±3.0 kJ/mol
Flash Point: 488.8±37.1 °C
Index of Refraction: 1.677
Molar Refractivity: 107.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: -1.78
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): -5.47
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 168 Å2
Polarizability: 42.4±0.5 10-24cm3
Surface Tension: 67.8±7.0 dyne/cm
Molar Volume: 284.0±7.0 cm3

Click to predict properties on the Chemicalize site


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