ChemSpider 2D Image | (3S)-3-Hydroxyheptadecanoic acid | C17H34O3

(3S)-3-Hydroxyheptadecanoic acid

  • Molecular FormulaC17H34O3
  • Average mass286.450 Da
  • Monoisotopic mass286.250793 Da
  • ChemSpider ID114101049

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Hydroxyheptadecanoic acid [ACD/IUPAC Name]
(3S)-3-Hydroxyheptadecansäure [German] [ACD/IUPAC Name]
Acide (3S)-3-hydroxyheptadécanoïque [French] [ACD/IUPAC Name]
Heptadecanoic acid, 3-hydroxy-, (3S)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 418.7±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 77.7±6.0 kJ/mol
Flash Point: 221.2±20.5 °C
Index of Refraction: 1.468
Molar Refractivity: 83.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 5.77
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 1316.71
ACD/KOC (pH 5.5): 2641.03
ACD/LogD (pH 7.4): 3.01
ACD/BCF (pH 7.4): 21.59
ACD/KOC (pH 7.4): 43.31
Polar Surface Area: 58 Å2
Polarizability: 33.2±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 301.7±3.0 cm3

Click to predict properties on the Chemicalize site


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