ChemSpider 2D Image | Triethyl 1,2,4-butanetricarboxylate | C13H22O6

Triethyl 1,2,4-butanetricarboxylate

  • Molecular FormulaC13H22O6
  • Average mass274.310 Da
  • Monoisotopic mass274.141632 Da
  • ChemSpider ID28599708

More details:

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

1,2,4-Butanetricarboxylate de triéthyle [French] [ACD/IUPAC Name]
1,2,4-Butanetricarboxylic acid, triethyl ester [ACD/Index Name]
1,2,4-Triethyl 1,2,4-butanetricarboxylate
1188-35-8 [RN]
Diethyl 3-(ethoxycarbonyl)hexanediate
Triethyl 1,2,4-butanetricarboxylate [ACD/IUPAC Name]
Triethyl-1,2,4-butantricarboxylat [German] [ACD/IUPAC Name]
1,2,4-triethyl butane-1,2,4-tricarboxylate
Diethyl3-(ethoxycarbonyl)hexanediate
MFCD28155103
More...

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

    Density: 1.1±0.1 g/cm3
    Boiling Point: 331.6±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 57.4±3.0 kJ/mol
    Flash Point: 141.2±22.4 °C
    Index of Refraction: 1.445
    Molar Refractivity: 67.6±0.3 cm3
    #H bond acceptors: 6
    #H bond donors: 0
    #Freely Rotating Bonds: 12
    #Rule of 5 Violations: 0
    ACD/LogP: 2.42
    ACD/LogD (pH 5.5): 2.26
    ACD/BCF (pH 5.5): 30.75
    ACD/KOC (pH 5.5): 404.21
    ACD/LogD (pH 7.4): 2.26
    ACD/BCF (pH 7.4): 30.75
    ACD/KOC (pH 7.4): 404.21
    Polar Surface Area: 79 Å2
    Polarizability: 26.8±0.5 10-24cm3
    Surface Tension: 35.7±3.0 dyne/cm
    Molar Volume: 253.9±3.0 cm3

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