ChemSpider 2D Image | Benzyl 7-methyloctyl phthalate | C24H30O4

Benzyl 7-methyloctyl phthalate

  • Molecular FormulaC24H30O4
  • Average mass382.493 Da
  • Monoisotopic mass382.214417 Da
  • ChemSpider ID28468116

More details:

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

1,2-Benzenedicarboxylic acid, 7-methyloctyl phenylmethyl ester [ACD/Index Name]
126198-74-1 [RN]
1-benzyl 2-(7-methyloctyl) benzene-1,2-dicarboxylate
Benzyl 7-methyloctyl phthalate [ACD/IUPAC Name]
Benzyl-7-methyloctyl-phthalat [German] [ACD/IUPAC Name]
Phtalate de benzyle et de 7-méthyloctyle [French] [ACD/IUPAC Name]
[126198-74-1] [RN]
1,2-Benzenedicarboxylic acid, 1-isononyl 2-(phenylmethyl) ester
1-BENZYL 2-(7-METHYLOCTYL) PHTHALATE
2-O-benzyl 1-O-(7-methyloctyl) benzene-1,2-dicarboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 469.5±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 73.2±3.0 kJ/mol
    Flash Point: 225.8±20.2 °C
    Index of Refraction: 1.534
    Molar Refractivity: 111.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 1
    ACD/LogP: 7.48
    ACD/LogD (pH 5.5): 6.93
    ACD/BCF (pH 5.5): 108711.35
    ACD/KOC (pH 5.5): 140134.16
    ACD/LogD (pH 7.4): 6.93
    ACD/BCF (pH 7.4): 108711.35
    ACD/KOC (pH 7.4): 140134.16
    Polar Surface Area: 53 Å2
    Polarizability: 44.1±0.5 10-24cm3
    Surface Tension: 40.6±3.0 dyne/cm
    Molar Volume: 358.4±3.0 cm3

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