ChemSpider 2D Image | 14-Methylpentadecanoate | C16H31O2

14-Methylpentadecanoate

  • Molecular FormulaC16H31O2
  • Average mass255.417 Da
  • Monoisotopic mass255.232956 Da
  • ChemSpider ID23255929

  • Charge - Charge

More details:

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

14-Methylpentadecanoat [German] [ACD/IUPAC Name]
14-Methylpentadecanoate [ACD/IUPAC Name]
14-Méthylpentadécanoate [French] [ACD/IUPAC Name]
Pentadecanoic acid, 14-methyl-, ion(1-) [ACD/Index Name]
14-methyl pentadecylate
14-methyl pentadecylic acid(1-)
14-methylpentadecanoic acid(1-)
isohexadecanoate
isopalmitate
isopalmitic acid(1-)
  • Miscellaneous

    • Chemical Class:

      A methyl-branched fatty acid anion that is the conjugate base of 14-methylpentadecanoic acid resulting from the deprotonation of the carboxy group; major microspecies at pH 7.3. ChEBI CHEBI:183088

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

Density:
Boiling Point: 371.0±10.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 67.9±6.0 kJ/mol
Flash Point: 207.1±7.4 °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: 6.97
ACD/LogD (pH 5.5): 5.30
ACD/BCF (pH 5.5): 4053.24
ACD/KOC (pH 5.5): 7902.90
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 65.02
ACD/KOC (pH 7.4): 126.78
Polar Surface Area: 40 Å2
Polarizability:
Surface Tension:
Molar Volume:

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