ChemSpider 2D Image | 1-{2-[(2E)-2-(1,3-Benzodioxol-5-ylmethylene)hydrazino]-2-oxoethyl}-6-methyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olate | C16H14N6O4

1-{2-[(2E)-2-(1,3-Benzodioxol-5-ylmethylene)hydrazino]-2-oxoethyl}-6-methyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olate

  • Molecular FormulaC16H14N6O4
  • Average mass354.320 Da
  • Monoisotopic mass354.107666 Da
  • ChemSpider ID22812550

  • Double-bond stereo - Double-bond stereo

More details:

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

1-{2-[(2E)-2-(1,3-Benzodioxol-5-ylmethylen)hydrazino]-2-oxoethyl}-6-methyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olat [German] [ACD/IUPAC Name]
1-{2-[(2E)-2-(1,3-Benzodioxol-5-ylmethylene)hydrazino]-2-oxoethyl}-6-methyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olate [ACD/IUPAC Name]
1-{2-[(2E)-2-(1,3-Benzodioxol-5-ylméthylène)hydrazino]-2-oxoéthyl}-6-méthyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olate [French] [ACD/IUPAC Name]
1H-1,2,4-Triazolo[4,3-b]pyridazin-4-ium, 1-[2-[(2E)-2-(1,3-benzodioxol-5-ylmethylene)hydrazinyl]-2-oxoethyl]-8-hydroxy-6-methyl-, inner salt [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: 10
#H bond donors: 2
#Freely Rotating Bonds: 4
#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: 118 Å2
Polarizability:
Surface Tension:
Molar Volume:

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