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Search term: CCCCCCCCCCCCCCCCCCCCCCCC(O)CC(=O)O (Found by conversion of search term to chemical structure (full match))

ChemSpider 2D Image | 3-Hydroxyhexacosanoic acid | C26H52O3

3-Hydroxyhexacosanoic acid

  • Molecular FormulaC26H52O3
  • Average mass412.689 Da
  • Monoisotopic mass412.391632 Da
  • ChemSpider ID23107013

More details:






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

122751-66-0 [RN]
3-Hydroxyhexacosanoic acid [ACD/IUPAC Name]
3-Hydroxyhexacosansäure [German] [ACD/IUPAC Name]
Acide 3-hydroxyhexacosanoïque [French] [ACD/IUPAC Name]
Hexacosanoic acid, 3-hydroxy- [ACD/Index Name]
3971502
3-hydroxycerotic acid
3-OH 26:0
3-OH C26:0
https://www.ebi.ac.uk/chebi/searchId.do?chebiId=CHEBI:52422
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

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

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