ChemSpider 2D Image | Diisotridecyl phthalate | C34H58O4

Diisotridecyl phthalate

  • Molecular FormulaC34H58O4
  • Average mass530.822 Da
  • Monoisotopic mass530.433533 Da
  • ChemSpider ID141908

More details:

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

Diisotridecyl phthalate
1,2-Benzenedicarboxylic acid, bis(11-methyldodecyl) ester [ACD/Index Name]
271-089-3 [EINECS]
27253-26-5 [RN]
68515-47-9 [RN]
bis(11-methyldodecyl) benzene-1,2-dicarboxylate
Bis(11-methyldodecyl) phthalate [ACD/IUPAC Name]
Bis(11-methyldodecyl)-phthalat [German] [ACD/IUPAC Name]
Phtalate de bis(11-méthyldodécyle) [French] [ACD/IUPAC Name]
1,2-Benzenedicarboxylic acid diisotridecyl ester

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

  • Miscellaneous
    • Toxicity:

      Organic Compound; Plasticizer; Aromatic Hydrocarbon; Phthalate; Ether; Ester; Food Toxin; Cosmetic Toxin; Household Toxin; Industrial/Workplace Toxin; Synthetic Compound Toxin, Toxin-Target Database T3D3650

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

Density: 0.9±0.1 g/cm3
Boiling Point: 483.0±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.8±3.0 kJ/mol
Flash Point: 260.0±9.3 °C
Index of Refraction: 1.484
Molar Refractivity: 160.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 14.02
ACD/LogD (pH 5.5): 12.07
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.07
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 53 Å2
Polarizability: 63.8±0.5 10-24cm3
Surface Tension: 34.9±3.0 dyne/cm
Molar Volume: 562.1±3.0 cm3

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