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Search term: 67491684 (Found by CSID)
ChemSpider 2D Image | 5-Butyl-3,4-dimethyl-2-furanundecanoic acid | C21H36O3

5-Butyl-3,4-dimethyl-2-furanundecanoic acid

  • Molecular FormulaC21H36O3
  • Average mass336.509 Da
  • Monoisotopic mass336.266449 Da
  • ChemSpider ID67491684

More details:

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

11-(5-Butyl-3,4-dimethyl-2-furyl)undecanoic acid [ACD/IUPAC Name]
11-(5-Butyl-3,4-dimethyl-2-furyl)undecansäure [German] [ACD/IUPAC Name]
116627-37-3 [RN]
2-Furanundecanoic acid, 5-butyl-3,4-dimethyl- [ACD/Index Name]
5-Butyl-3,4-dimethyl-2-furanundecanoic acid
Acide 11-(5-butyl-3,4-diméthyl-2-furyl)undécanoïque [French] [ACD/IUPAC Name]
11-(3,4-dimethyl-5-butylfuran-2-yl)-undecanoic acid
11-(5-butyl-3,4-dimethylfuran-2-yl)undecanoic acid
11-(5-butyl-3,4-dimethylfuran-2-yl)-undecanoic acid
11D4
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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: 462.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 233.4±27.3 °C
Index of Refraction: 1.488
Molar Refractivity: 99.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 8.02
ACD/LogD (pH 5.5): 6.01
ACD/BCF (pH 5.5): 14039.35
ACD/KOC (pH 5.5): 19228.44
ACD/LogD (pH 7.4): 4.22
ACD/BCF (pH 7.4): 225.22
ACD/KOC (pH 7.4): 308.46
Polar Surface Area: 50 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 346.6±3.0 cm3

Click to predict properties on the Chemicalize site


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