ChemSpider 2D Image | 4,4'-[1,4-Phenylenebis(oxy-4,1-phenylene)]bis(4-azatricyclo[5.2.1.0~2,6~]dec-8-ene-3,5-dione) | C36H28N2O6

4,4'-[1,4-Phenylenebis(oxy-4,1-phenylene)]bis(4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione)

  • Molecular FormulaC36H28N2O6
  • Average mass584.617 Da
  • Monoisotopic mass584.194763 Da
  • ChemSpider ID2112408

More details:

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

4,4'-[1,4-Phenylenbis(oxy-4,1-phenylen)]bis(4-azatricyclo[5.2.1.02,6]dec-8-en-3,5-dion) [German] [ACD/IUPAC Name]
4,4'-[1,4-Phenylenebis(oxy-4,1-phenylene)]bis(4-azatricyclo[5.2.1.02,6]dec-8-ene-3,5-dione) [ACD/IUPAC Name]
4,4'-[1,4-Phénylènebis(oxy-4,1-phénylène)]bis(4-azatricyclo[5.2.1.02,6]déc-8-ène-3,5-dione) [French] [ACD/IUPAC Name]
4,7-Methano-1H-isoindole-1,3(2H)-dione, 2,2'-[1,4-phenylenebis(oxy-4,1-phenylene)]bis[3a,4,7,7a-tetrahydro- [ACD/Index Name]

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

CBDivE_014481 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.687
Molar Refractivity: 157.6±0.3 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 4.35
ACD/LogD (pH 5.5): 4.43
ACD/BCF (pH 5.5): 1365.22
ACD/KOC (pH 5.5): 6106.29
ACD/LogD (pH 7.4): 4.43
ACD/BCF (pH 7.4): 1365.22
ACD/KOC (pH 7.4): 6106.29
Polar Surface Area: 93 Å2
Polarizability: 62.5±0.5 10-24cm3
Surface Tension: 62.5±3.0 dyne/cm
Molar Volume: 413.7±3.0 cm3

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