ChemSpider 2D Image | (9E)-9-Hexadecenoate | C16H29O2

(9E)-9-Hexadecenoate

  • Molecular FormulaC16H29O2
  • Average mass253.401 Da
  • Monoisotopic mass253.217300 Da
  • ChemSpider ID28533594

  • Charge - Charge

More details:

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

(9E)-9-Hexadecenoat [German] [ACD/IUPAC Name]
(9E)-9-Hexadecenoate [ACD/IUPAC Name]
(9E)-9-Hexadécénoate [French] [ACD/IUPAC Name]
9-Hexadecenoic acid, ion(1-), (9E)- [ACD/Index Name]
9-Hexadecenoate
9-hexadecenoate(1-)
hexadec-9-enoate
hexadec-9-enoate(1-)
  • Miscellaneous

    • Chemical Class:

      A long-chain unsaturated fatty acid anion that is the conjugate base of hexadec-9-enoic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. ChEBI CHEBI:71449

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

Density:
Boiling Point: 363.6±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 239.2±14.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 6.64
ACD/LogD (pH 5.5): 5.51
ACD/BCF (pH 5.5): 5809.70
ACD/KOC (pH 5.5): 10215.60
ACD/LogD (pH 7.4): 3.71
ACD/BCF (pH 7.4): 93.17
ACD/KOC (pH 7.4): 163.82
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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