ChemSpider 2D Image | 2,9-Diphenyl-3a,14-dihydroisoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone | C36H20N2O4

2,9-Diphenyl-3a,14-dihydroisoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone

  • Molecular FormulaC36H20N2O4
  • Average mass544.555 Da
  • Monoisotopic mass544.142334 Da
  • ChemSpider ID109800724

More details:

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

2,9-Diphenyl-3a,14-dihydroisochinolino[4',5',6':6,5,10]anthra[2,1,9-def]isochinolin-1,3,8,10(2H,9H)-tetron [German] [ACD/IUPAC Name]
2,9-Diphényl-3a,14-dihydroisoquinoléino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoléine-1,3,8,10(2H,9H)-tétrone [French] [ACD/IUPAC Name]
2,9-Diphenyl-3a,14-dihydroisoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone [ACD/IUPAC Name]
Isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone, 3a,14-dihydro-2,9-diphenyl- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.850
Molar Refractivity: 155.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 3.81
ACD/LogD (pH 5.5): 5.06
ACD/BCF (pH 5.5): 4145.96
ACD/KOC (pH 5.5): 13509.23
ACD/LogD (pH 7.4): 5.07
ACD/BCF (pH 7.4): 4161.23
ACD/KOC (pH 7.4): 13558.96
Polar Surface Area: 75 Å2
Polarizability: 61.5±0.5 10-24cm3
Surface Tension: 89.4±5.0 dyne/cm
Molar Volume: 347.1±5.0 cm3

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