ChemSpider 2D Image | (1R,2R,3R,4S)-1,3,4-Triacetoxy-11-diazonio-2-hydroxy-2-methyl-9,10-dioxo-2,3,4,9,9a,10-hexahydro-1H-benzo[b]fluoren-5-olate | C24H20N2O10

(1R,2R,3R,4S)-1,3,4-Triacetoxy-11-diazonio-2-hydroxy-2-methyl-9,10-dioxo-2,3,4,9,9a,10-hexahydro-1H-benzo[b]fluoren-5-olate

  • Molecular FormulaC24H20N2O10
  • Average mass496.423 Da
  • Monoisotopic mass496.111786 Da
  • ChemSpider ID58129197

  • defined stereocentres - 4 of 5 defined stereocentres

More details:

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

(1R,2R,3R,4S)-1,3,4-Triacetoxy-11-diazonio-2-hydroxy-2-methyl-9,10-dioxo-2,3,4,9,9a,10-hexahydro-1H-benzo[b]fluoren-5-olat [German] [ACD/IUPAC Name]
(1R,2R,3R,4S)-1,3,4-Triacetoxy-11-diazonio-2-hydroxy-2-methyl-9,10-dioxo-2,3,4,9,9a,10-hexahydro-1H-benzo[b]fluoren-5-olate [ACD/IUPAC Name]
(1R,2R,3R,4S)-1,3,4-Triacétoxy-11-diazonio-2-hydroxy-2-méthyl-9,10-dioxo-2,3,4,9,9a,10-hexahydro-1H-benzo[b]fluorén-5-olate [French] [ACD/IUPAC Name]
1H-Benzo[b]fluorene-11-diazonium, 1,3,4-tris(acetyloxy)-2,3,4,9,9a,10-hexahydro-2,5-dihydroxy-2-methyl-9,10-dioxo-, inner salt, (1R,2R,3R,4S)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3349322/

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

Density:
Boiling Point:
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Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 12
#H bond donors: 2
#Freely Rotating Bonds: 7
#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: 184 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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