ChemSpider 2D Image | MFCD00191654 | C6H8O3

MFCD00191654

  • Molecular FormulaC6H8O3
  • Average mass128.126 Da
  • Monoisotopic mass128.047348 Da
  • ChemSpider ID24589864

More details:

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

18418-08-1 [RN]
2-Hydroxy-3-butynoate d'éthyle [French] [ACD/IUPAC Name]
3-Butynoic acid, 2-hydroxy-, ethyl ester [ACD/Index Name]
Ethyl 2-hydroxy-3-butynoate [ACD/IUPAC Name]
Ethyl 2-hydroxybut-3-ynoate
Ethyl-2-hydroxy-3-butinoat [German] [ACD/IUPAC Name]
MFCD00191654
[18418-08-1] [RN]
2-hydroxy-3-butynoate
2-HYDROXY-3-BUTYNOIC ACID ETHYL ESTER
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: 199.7±25.0 °C at 760 mmHg
    Vapour Pressure: 0.1±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 50.7±6.0 kJ/mol
    Flash Point: 81.1±15.9 °C
    Index of Refraction: 1.461
    Molar Refractivity: 30.9±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 1
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.29
    ACD/LogD (pH 5.5): 0.39
    ACD/BCF (pH 5.5): 1.16
    ACD/KOC (pH 5.5): 38.74
    ACD/LogD (pH 7.4): 0.39
    ACD/BCF (pH 7.4): 1.16
    ACD/KOC (pH 7.4): 38.73
    Polar Surface Area: 47 Å2
    Polarizability: 12.3±0.5 10-24cm3
    Surface Tension: 43.1±3.0 dyne/cm
    Molar Volume: 112.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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