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Search term: JXBLMIJDQFTVIE (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 3-Methyl-5-pentyl-2-furantridecanoic Acid | C23H40O3

3-Methyl-5-pentyl-2-furantridecanoic Acid

  • Molecular FormulaC23H40O3
  • Average mass364.562 Da
  • Monoisotopic mass364.297760 Da
  • ChemSpider ID57494632

More details:

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

13-(3-Methyl-5-pentyl-2-furyl)tridecanoic acid [ACD/IUPAC Name]
13-(3-Methyl-5-pentyl-2-furyl)tridecansäure [German] [ACD/IUPAC Name]
2-Furantridecanoic acid, 3-methyl-5-pentyl- [ACD/Index Name]
3-Methyl-5-pentyl-2-furantridecanoic Acid
57818-42-5 [RN]
Acide 13-(3-méthyl-5-pentyl-2-furyl)tridécanoïque [French] [ACD/IUPAC Name]
13-(3-methyl-5-pentylfuran-2-yl)-tridecanoic acid
13-(3-METHYL-5-PENTYLFURAN-2-YL)TRIDECANOIC ACID
13-(5-pentyl-3-methylfuran-2-yl)-tridecanoic acid
13M5
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.0±0.1 g/cm3
Boiling Point: 484.4±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 246.7±27.3 °C
Index of Refraction: 1.485
Molar Refractivity: 108.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 9.16
ACD/LogD (pH 5.5): 7.25
ACD/BCF (pH 5.5): 122604.85
ACD/KOC (pH 5.5): 90709.46
ACD/LogD (pH 7.4): 5.45
ACD/BCF (pH 7.4): 1966.88
ACD/KOC (pH 7.4): 1455.20
Polar Surface Area: 50 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 36.1±3.0 dyne/cm
Molar Volume: 379.9±3.0 cm3

Click to predict properties on the Chemicalize site


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