Found 1 result

Search term: 89-04-3 (Found by approved synonym)
ChemSpider 2D Image | Trioctyl trimellitate | C33H54O6

Trioctyl trimellitate

  • Molecular FormulaC33H54O6
  • Average mass546.778 Da
  • Monoisotopic mass546.392029 Da
  • ChemSpider ID6694

More details:

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

1,2,4-Benzènetricarboxylate de trioctyle [French] [ACD/IUPAC Name]
1,2,4-Benzenetricarboxylic acid, tricapryl ester
1,2,4-Benzenetricarboxylic acid, trioctyl ester [ACD/Index Name]
201-877-4 [EINECS]
89-04-3 [RN]
9OVR BVO9 DVO9 [WLN]
Trioctyl 1,2,4-benzenetricarboxylate [ACD/IUPAC Name]
Trioctyl benzene-1,2,4-tricarboxylate
Trioctyl trimellitate
Trioctyl-1,2,4-benzoltricarboxylat [German] [ACD/IUPAC Name]
More...

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

9GPJ04URH3 [DBID]
HSDB 5263 [DBID]
PX 338 [DBID]
UNII:9GPJ04URH3 [DBID]
UNII-9GPJ04URH3 [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: 594.8±30.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.7 mmHg at 25°C
    Enthalpy of Vaporization: 88.6±3.0 kJ/mol
    Flash Point: 242.5±24.6 °C
    Index of Refraction: 1.490
    Molar Refractivity: 158.9±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 27
    #Rule of 5 Violations: 2
    ACD/LogP: 13.35
    ACD/LogD (pH 5.5): 12.38
    ACD/BCF (pH 5.5): 1000000.00
    ACD/KOC (pH 5.5): 10000000.00
    ACD/LogD (pH 7.4): 12.38
    ACD/BCF (pH 7.4): 1000000.00
    ACD/KOC (pH 7.4): 10000000.00
    Polar Surface Area: 79 Å2
    Polarizability: 63.0±0.5 10-24cm3
    Surface Tension: 37.2±3.0 dyne/cm
    Molar Volume: 549.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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