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Search term: 53894-23-8 (Found by approved synonym)
ChemSpider 2D Image | Triisononyl trimellitate | C36H60O6

Triisononyl trimellitate

  • Molecular FormulaC36H60O6
  • Average mass588.858 Da
  • Monoisotopic mass588.438965 Da
  • ChemSpider ID94463

More details:

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

1,2,4-Benzènetricarboxylate de tris(7-méthyloctyle) [French] [ACD/IUPAC Name]
1,2,4-Benzenetricarboxylic acid, triisononyl ester
1,2,4-Benzenetricarboxylic acid, tris(7-methyloctyl) ester [ACD/Index Name]
258-847-9 [EINECS]
53894-23-8 [RN]
Triisononyl trimellitate
Tris(7-methyloctyl) 1,2,4-benzenetricarboxylate [ACD/IUPAC Name]
tris(7-methyloctyl) benzene-1,2,4-tricarboxylate
Tris(7-methyloctyl)-1,2,4-benzoltricarboxylat [German] [ACD/IUPAC Name]
[53894-23-8] [RN]
More...

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

T06P0GMA66 [DBID]
UNII:T06P0GMA66 [DBID]

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

    Density: 1.0±0.1 g/cm3
    Boiling Point: 617.6±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 91.6±3.0 kJ/mol
    Flash Point: 248.6±26.0 °C
    Index of Refraction: 1.487
    Molar Refractivity: 172.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 27
    #Rule of 5 Violations: 2
    ACD/LogP: 14.39
    ACD/LogD (pH 5.5): 12.15
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 12.15
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 79 Å2
    Polarizability: 68.4±0.5 10-24cm3
    Surface Tension: 35.8±3.0 dyne/cm
    Molar Volume: 600.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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