ChemSpider 2D Image | N,N'-(5-{[(1Z)-1-(5-Acetyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-ylidene)ethyl]amino}-1,3-phenylene)bis(2,3-dihydroxypropanamide) | C21H23N3O11

N,N'-(5-{[(1Z)-1-(5-Acetyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-ylidene)ethyl]amino}-1,3-phenylene)bis(2,3-dihydroxypropanamide)

  • Molecular FormulaC21H23N3O11
  • Average mass493.421 Da
  • Monoisotopic mass493.133270 Da
  • ChemSpider ID34243442

  • Double-bond stereo - Double-bond stereo

More details:

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

N,N'-(5-{[(1Z)-1-(5-Acetyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-yliden)ethyl]amino}-1,3-phenylen)bis(2,3-dihydroxypropanamid) [German] [ACD/IUPAC Name]
N,N'-(5-{[(1Z)-1-(5-Acetyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-ylidene)ethyl]amino}-1,3-phenylene)bis(2,3-dihydroxypropanamide) [ACD/IUPAC Name]
N,N'-(5-{[(1Z)-1-(5-Acétyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-ylidène)éthyl]amino}-1,3-phénylène)bis(2,3-dihydroxypropanamide) [French] [ACD/IUPAC Name]
Propanamide, N,N'-[5-[[(1Z)-1-(5-acetyl-4-hydroxy-2,6-dioxo-2H-pyran-3(6H)-ylidene)ethyl]amino]-1,3-phenylene]bis[2,3-dihydroxy- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 822.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 125.4±3.0 kJ/mol
Flash Point: 451.4±34.3 °C
Index of Refraction: 1.752
Molar Refractivity: 117.2±0.3 cm3
#H bond acceptors: 14
#H bond donors: 8
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: -0.89
ACD/LogD (pH 5.5): -2.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -4.32
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 232 Å2
Polarizability: 46.5±0.5 10-24cm3
Surface Tension: 116.7±3.0 dyne/cm
Molar Volume: 287.2±3.0 cm3

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