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Search term: C[C@H](O)CCCCCCCCCCCCCCCC(=O)O (Found by conversion of search term to chemical structure (full match))

ChemSpider 2D Image | (17S)-17-Hydroxyoctadecanoic acid | C18H36O3

(17S)-17-Hydroxyoctadecanoic acid

  • Molecular FormulaC18H36O3
  • Average mass300.477 Da
  • Monoisotopic mass300.266449 Da
  • ChemSpider ID34992678
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

(17S)-17-Hydroxyoctadecanoic acid [ACD/IUPAC Name]
(17S)-17-Hydroxyoctadecansäure [German] [ACD/IUPAC Name]
Acide (17S)-17-hydroxyoctadécanoïque [French] [ACD/IUPAC Name]
Octadecanoic acid, 17-hydroxy-, (17S)- [ACD/Index Name]
(s)-17-hydroxy stearic acid
17-HYDROXYSTEARIC ACID
4552-19-6 [RN]
UNII-O0217BD3D2

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.9±0.1 g/cm3
Boiling Point: 436.3±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.0±6.0 kJ/mol
Flash Point: 231.8±17.7 °C
Index of Refraction: 1.468
Molar Refractivity: 88.5±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 1
ACD/LogP: 6.03
ACD/LogD (pH 5.5): 4.71
ACD/BCF (pH 5.5): 1436.54
ACD/KOC (pH 5.5): 3761.26
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 23.05
ACD/KOC (pH 7.4): 60.34
Polar Surface Area: 58 Å2
Polarizability: 35.1±0.5 10-24cm3
Surface Tension: 36.9±3.0 dyne/cm
Molar Volume: 318.2±3.0 cm3

Click to predict properties on the Chemicalize site






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