ChemSpider 2D Image | PBI | C34H30N2O4

PBI

  • Molecular FormulaC34H30N2O4
  • Average mass530.613 Da
  • Monoisotopic mass530.220581 Da
  • ChemSpider ID11189798

More details:

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

110590-81-3 [RN]
2,9-Di(3-pentanyl)isochinolino[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-Di(3-pentanyl)isoquinoléino[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-Di(3-pentanyl)isoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone [ACD/IUPAC Name]
2,9-Di(pent-3-yl)-anthra[2,1,9-def,6,5,10-d'e'f']diisoquinoline-1,3,8,10-tetrone
2,9-Di(pentan-3-yl)anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetraone
Anthra[2,1,9-def:6,5,10-d'e'f']diisoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis(1-ethylpropyl)-
Isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis(1-ethylpropyl)- [ACD/Index Name]
MFCD00799275
N,N-Bis(ethylpropyl)perylene-3,4,9,10-tetracarboxylicdiimide
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 724.1±33.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.3 mmHg at 25°C
    Enthalpy of Vaporization: 105.7±3.0 kJ/mol
    Flash Point: 314.9±17.7 °C
    Index of Refraction: 1.746
    Molar Refractivity: 159.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.76
    ACD/LogD (pH 5.5): 6.25
    ACD/BCF (pH 5.5): 32940.76
    ACD/KOC (pH 5.5): 59618.05
    ACD/LogD (pH 7.4): 6.25
    ACD/BCF (pH 7.4): 32940.76
    ACD/KOC (pH 7.4): 59618.05
    Polar Surface Area: 75 Å2
    Polarizability: 63.2±0.5 10-24cm3
    Surface Tension: 66.4±3.0 dyne/cm
    Molar Volume: 392.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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