ChemSpider 2D Image | Pigment red 149 | C40H26N2O4

Pigment red 149

  • Molecular FormulaC40H26N2O4
  • Average mass598.645 Da
  • Monoisotopic mass598.189270 Da
  • ChemSpider ID56322

More details:

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

2,9-Bis(3,5-dimethylphenyl)anthra(2,1,9-def:6,5,10-d'e'f')diisoquinoline-1,3,8,10(2H,9H)-tetrone
2,9-Bis(3,5-dimethylphenyl)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-bis(3,5-dimethylphenyl)isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone
2,9-Bis(3,5-diméthylphényl)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-Bis(3,5-dimethylphenyl)isoquinolino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone [ACD/IUPAC Name]
225-590-9 [EINECS]
4948-15-6 [RN]
ANTHRA(2,1,9-DEF:6,5,10-D'E'F')DIISOQUINOLINE-1,3,8,10(2H,9H)-TETRONE, 2,9-BIS(3,5-DIMETHYLPHENYL)-
C.I. Pigment Red 149
Isoquino[4',5',6':6,5,10]anthra[2,1,9-def]isoquinoline-1,3,8,10(2H,9H)-tetrone, 2,9-bis(3,5-dimethylphenyl)- [ACD/Index Name]
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

    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: 1.822
    Molar Refractivity: 181.3±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 2
    ACD/LogP: 7.22
    ACD/LogD (pH 5.5): 7.47
    ACD/BCF (pH 5.5): 281347.50
    ACD/KOC (pH 5.5): 276483.34
    ACD/LogD (pH 7.4): 7.47
    ACD/BCF (pH 7.4): 282415.56
    ACD/KOC (pH 7.4): 277532.94
    Polar Surface Area: 75 Å2
    Polarizability: 71.9±0.5 10-24cm3
    Surface Tension: 75.3±3.0 dyne/cm
    Molar Volume: 415.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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