ChemSpider 2D Image | (S)-3-hydroxyhexacosanoic acid | C26H52O3

(S)-3-hydroxyhexacosanoic acid

  • Molecular FormulaC26H52O3
  • Average mass412.689 Da
  • Monoisotopic mass412.391632 Da
  • ChemSpider ID23107014

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Hydroxyhexacosanoic acid [ACD/IUPAC Name]
(3S)-3-Hydroxyhexacosansäure [German] [ACD/IUPAC Name]
(S)-3-hydroxyhexacosanoic acid
Acide (3S)-3-hydroxyhexacosanoïque [French] [ACD/IUPAC Name]
Hexacosanoic acid, 3-hydroxy-, (3S)- [ACD/Index Name]
3S-hydroxyhexacosanoic 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: 532.3±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 92.9±6.0 kJ/mol
Flash Point: 289.8±21.9 °C
Index of Refraction: 1.470
Molar Refractivity: 125.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 1
ACD/LogP: 10.55
ACD/LogD (pH 5.5): 8.60
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 307039.72
ACD/LogD (pH 7.4): 6.81
ACD/BCF (pH 7.4): 16591.11
ACD/KOC (pH 7.4): 5035.64
Polar Surface Area: 58 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 450.2±3.0 cm3

Click to predict properties on the Chemicalize site


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