ChemSpider 2D Image | Ethyl Tetrahydropyran-4-carboxylate | C8H14O3

Ethyl Tetrahydropyran-4-carboxylate

  • Molecular FormulaC8H14O3
  • Average mass158.195 Da
  • Monoisotopic mass158.094299 Da
  • ChemSpider ID14270435

More details:

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

2H-Pyran-4-carboxylic acid, tetrahydro-, ethyl ester [ACD/Index Name]
96835-17-5 [RN]
Ethyl tetrahydro-2H-pyran-4-carboxylate [ACD/IUPAC Name]
Ethyl Tetrahydropyran-4-carboxylate
Ethyl-tetrahydro-2H-pyran-4-carboxylat [German] [ACD/IUPAC Name]
Tétrahydro-2H-pyrane-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
[96835-17-5] [RN]
2H-Pyran-4-carboxylic acid tetrahydro ethyl ester
2H-Pyran-4-carboxylicacid,tetrahydro-,ethyl ester
4-oxanecarboxylic acid ethyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [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: 209.5±33.0 °C at 760 mmHg
    Vapour Pressure: 0.2±0.4 mmHg at 25°C
    Enthalpy of Vaporization: 44.6±3.0 kJ/mol
    Flash Point: 79.1±20.0 °C
    Index of Refraction: 1.444
    Molar Refractivity: 40.2±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.87
    ACD/LogD (pH 5.5): 1.13
    ACD/BCF (pH 5.5): 4.27
    ACD/KOC (pH 5.5): 98.38
    ACD/LogD (pH 7.4): 1.13
    ACD/BCF (pH 7.4): 4.27
    ACD/KOC (pH 7.4): 98.38
    Polar Surface Area: 36 Å2
    Polarizability: 16.0±0.5 10-24cm3
    Surface Tension: 33.5±3.0 dyne/cm
    Molar Volume: 151.6±3.0 cm3

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