ChemSpider 2D Image | (~2~H_5_)Ethyl (6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoate | C20H27D5O2

(2H5)Ethyl (6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoate

  • Molecular FormulaC20H27D5O2
  • Average mass309.498 Da
  • Monoisotopic mass309.271606 Da
  • ChemSpider ID58793953

  • Double-bond stereo - Double-bond stereo

    Non-standard isotope - Non-standard isotope

More details:

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

(2H5)Ethyl (6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoate [ACD/IUPAC Name]
(2H5)Ethyl-(6Z,9Z,12Z,15Z)-6,9,12,15-octadecatetraenoat [German] [ACD/IUPAC Name]
(6Z,9Z,12Z,15Z)-6,9,12,15-Octadécatétraénoate de (2H5)éthyle [French] [ACD/IUPAC Name]
6,9,12,15-Octadecatetraenoic acid, ethyl-d5 ester, (6Z,9Z,12Z,15Z)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 389.4±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.9±3.0 kJ/mol
Flash Point: 103.1±23.2 °C
Index of Refraction: 1.486
Molar Refractivity: 96.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 6.88
ACD/LogD (pH 5.5): 6.22
ACD/BCF (pH 5.5): 31450.65
ACD/KOC (pH 5.5): 57675.02
ACD/LogD (pH 7.4): 6.22
ACD/BCF (pH 7.4): 31450.65
ACD/KOC (pH 7.4): 57675.02
Polar Surface Area: 26 Å2
Polarizability: 38.3±0.5 10-24cm3
Surface Tension: 32.1±3.0 dyne/cm
Molar Volume: 336.6±3.0 cm3

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