ChemSpider 2D Image | (2S)-2-Methylpentadecanoic acid | C16H32O2

(2S)-2-Methylpentadecanoic acid

  • Molecular FormulaC16H32O2
  • Average mass256.424 Da
  • Monoisotopic mass256.240234 Da
  • ChemSpider ID67156656

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-Methylpentadecanoic acid [ACD/IUPAC Name]
(2S)-2-Methylpentadecansäure [German] [ACD/IUPAC Name]
Acide (2S)-2-méthylpentadécanoïque [French] [ACD/IUPAC Name]
Pentadecanoic acid, 2-methyl-, (2S)- [ACD/Index Name]
S-methylpentadecanoic acid

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

Density: 0.9±0.1 g/cm3
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: 1.453
Molar Refractivity: 77.7±0.3 cm3
#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): 6.16
ACD/BCF (pH 5.5): 18520.09
ACD/KOC (pH 5.5): 23947.02
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 299.71
ACD/KOC (pH 7.4): 387.53
Polar Surface Area: 37 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 32.7±3.0 dyne/cm
Molar Volume: 287.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement