ChemSpider 2D Image | (~2~H_5_)Ethyl (9Z)-9-hexadecenoate | C18H29D5O2

(2H5)Ethyl (9Z)-9-hexadecenoate

  • Molecular FormulaC18H29D5O2
  • Average mass287.492 Da
  • Monoisotopic mass287.287262 Da
  • ChemSpider ID58793902
  • 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 (9Z)-9-hexadecenoate [ACD/IUPAC Name]
(2H5)Ethyl-(9Z)-9-hexadecenoat [German] [ACD/IUPAC Name]
(9Z)-9-Hexadécénoate de (2H5)éthyle [French] [ACD/IUPAC Name]
9-Hexadecenoic acid, ethyl-d5 ester, (9Z)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 355.5±21.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.1±3.0 kJ/mol
Flash Point: 92.7±20.4 °C
Index of Refraction: 1.453
Molar Refractivity: 87.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 7.63
ACD/LogD (pH 5.5): 7.14
ACD/BCF (pH 5.5): 155714.63
ACD/KOC (pH 5.5): 181236.81
ACD/LogD (pH 7.4): 7.14
ACD/BCF (pH 7.4): 155714.63
ACD/KOC (pH 7.4): 181236.81
Polar Surface Area: 26 Å2
Polarizability: 34.6±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 322.8±3.0 cm3

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