ChemSpider 2D Image | Ethyl (Z)-hex-2-enoate | C8H14O2

Ethyl (Z)-hex-2-enoate

  • Molecular FormulaC8H14O2
  • Average mass142.196 Da
  • Monoisotopic mass142.099380 Da
  • ChemSpider ID21419889
  • Double-bond stereo - Double-bond stereo


More details:






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

(2Z)-2-Hexénoate d'éthyle [French] [ACD/IUPAC Name]
27829-71-6 [RN]
2-Hexenoic acid, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-2-hexenoate
Ethyl (2Z)-hex-2-enoate [ACD/IUPAC Name]
Ethyl (Z)-hex-2-enoate [ACD/IUPAC Name]
Ethyl-(2Z)-2-hexenoat [German] [ACD/IUPAC Name]
FEMA 4613 (Component)
MFCD27937360 [MDL number]

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

3R9Y6MH3AN [DBID]
UNII:3R9Y6MH3AN [DBID]
UNII-3R9Y6MH3AN [DBID]

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

    Density: 0.9±0.1 g/cm3
    Boiling Point: 172.6±9.0 °C at 760 mmHg
    Vapour Pressure: 1.3±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 40.9±3.0 kJ/mol
    Flash Point: 62.3±6.2 °C
    Index of Refraction: 1.433
    Molar Refractivity: 40.9±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.91
    ACD/LogD (pH 5.5): 2.42
    ACD/BCF (pH 5.5): 40.83
    ACD/KOC (pH 5.5): 495.15
    ACD/LogD (pH 7.4): 2.42
    ACD/BCF (pH 7.4): 40.83
    ACD/KOC (pH 7.4): 495.15
    Polar Surface Area: 26 Å2
    Polarizability: 16.2±0.5 10-24cm3
    Surface Tension: 27.9±3.0 dyne/cm
    Molar Volume: 157.7±3.0 cm3

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