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Search term: InChIKey=KETXIYUCVSWJBJ-UHFFFAOYSA-N (Found by InChIKey (full match))

ChemSpider 2D Image | 23-Methylpentacosanoic acid | C26H52O2

23-Methylpentacosanoic acid

  • Molecular FormulaC26H52O2
  • Average mass396.690 Da
  • Monoisotopic mass396.396729 Da
  • ChemSpider ID28686146

More details:






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

23-Methylpentacosanoic acid [ACD/IUPAC Name]
23-Methylpentacosansäure [German] [ACD/IUPAC Name]
Acide 23-méthylpentacosanoïque [French] [ACD/IUPAC Name]
Pentacosanoic acid, 23-methyl- [ACD/Index Name]
142178-70-9 [RN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 508.6±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 85.3±6.0 kJ/mol
Flash Point: 289.2±9.6 °C
Index of Refraction: 1.460
Molar Refractivity: 124.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 1
ACD/LogP: 12.28
ACD/LogD (pH 5.5): 9.81
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2229637.00
ACD/LogD (pH 7.4): 8.01
ACD/BCF (pH 7.4): 172383.42
ACD/KOC (pH 7.4): 35768.96
Polar Surface Area: 37 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 33.1±3.0 dyne/cm
Molar Volume: 452.7±3.0 cm3

Click to predict properties on the Chemicalize site






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