ChemSpider 2D Image | (4E)-4-{5-[(E)-(Diphenylhydrazono)methyl]-1-hexyl-2H-pyrrolium-2-ylidene}-2-{5-[(E)-(diphenylhydrazono)methyl]-1-hexyl-1H-pyrrol-2-yl}-3-oxo-1-cyclobuten-1-olate | C50H52N6O2

(4E)-4-{5-[(E)-(Diphenylhydrazono)methyl]-1-hexyl-2H-pyrrolium-2-ylidene}-2-{5-[(E)-(diphenylhydrazono)methyl]-1-hexyl-1H-pyrrol-2-yl}-3-oxo-1-cyclobuten-1-olate

  • Molecular FormulaC50H52N6O2
  • Average mass768.987 Da
  • Monoisotopic mass768.415161 Da
  • ChemSpider ID30660099

More details:






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

(4E)-4-{5-[(E)-(Diphenylhydrazono)methyl]-1-hexyl-2H-pyrrolium-2-yliden}-2-{5-[(E)-(diphenylhydrazono)methyl]-1-hexyl-1H-pyrrol-2-yl}-3-oxo-1-cyclobuten-1-olat [German] [ACD/IUPAC Name]
(4E)-4-{5-[(E)-(Diphenylhydrazono)methyl]-1-hexyl-2H-pyrrolium-2-ylidene}-2-{5-[(E)-(diphenylhydrazono)methyl]-1-hexyl-1H-pyrrol-2-yl}-3-oxo-1-cyclobuten-1-olate [ACD/IUPAC Name]
(4E)-4-{5-[(E)-(Diphénylhydrazono)méthyl]-1-hexyl-2H-pyrrolium-2-ylidène}-2-{5-[(E)-(diphénylhydrazono)méthyl]-1-hexyl-1H-pyrrol-2-yl}-3-oxo-1-cyclobutén-1-olate [French] [ACD/IUPAC Name]
2H-Pyrrolium, 5-[(E)-(2,2-diphenylhydrazinylidene)methyl]-2-[3-[5-[(E)-(2,2-diphenylhydrazinylidene)methyl]-1-hexyl-1H-pyrrol-2-yl]-2-hydroxy-4-oxo-2-cyclobuten-1-ylidene]-1-hexyl-, inner salt, (2E)- [ACD/Index Name]

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

Density:
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Index of Refraction:
Molar Refractivity:
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 19
#Rule of 5 Violations:
ACD/LogP:
ACD/LogD (pH 5.5):
ACD/BCF (pH 5.5):
ACD/KOC (pH 5.5):
ACD/LogD (pH 7.4):
ACD/BCF (pH 7.4):
ACD/KOC (pH 7.4):
Polar Surface Area: 79 Å2
Polarizability:
Surface Tension:
Molar Volume:

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