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Search term: InChIKey=UPFFOYWRLISZHP-UHFFFAOYSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | Methyl 9-(3-methyl-5-pentyl-2-furyl)nonanoate | C20H34O3

Methyl 9-(3-methyl-5-pentyl-2-furyl)nonanoate

  • Molecular FormulaC20H34O3
  • Average mass322.482 Da
  • Monoisotopic mass322.250793 Da
  • ChemSpider ID62815839

More details:

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

2-Furannonanoic acid, 3-methyl-5-pentyl-, methyl ester [ACD/Index Name]
9-(3-Méthyl-5-pentyl-2-furyl)nonanoate de méthyle [French] [ACD/IUPAC Name]
Methyl 9-(3-methyl-5-pentyl-2-furyl)nonanoate [ACD/IUPAC Name]
Methyl-9-(3-methyl-5-pentyl-2-furyl)nonanoat [German] [ACD/IUPAC Name]
76859-09-1 [RN]
9-(3-methyl-5-pentylfuran-2-yl)-nonanoic acid methyl ester
9-(3-Methyl-5-pentylfuran-2-yl)nonanoic acid methyl ester

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

Density: 1.0±0.1 g/cm3
Boiling Point: 404.2±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.6±3.0 kJ/mol
Flash Point: 169.7±12.0 °C
Index of Refraction: 1.473
Molar Refractivity: 95.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 7.49
ACD/LogD (pH 5.5): 7.17
ACD/BCF (pH 5.5): 166390.30
ACD/KOC (pH 5.5): 190046.59
ACD/LogD (pH 7.4): 7.17
ACD/BCF (pH 7.4): 166390.30
ACD/KOC (pH 7.4): 190046.59
Polar Surface Area: 39 Å2
Polarizability: 37.7±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 339.2±3.0 cm3

Click to predict properties on the Chemicalize site


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