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Search term: 74849731 (Found by CSID)
ChemSpider 2D Image | 11-{3,4-Dimethyl-5-[(1E)-1-penten-1-yl]-2-furyl}undecanoic acid | C22H36O3

11-{3,4-Dimethyl-5-[(1E)-1-penten-1-yl]-2-furyl}undecanoic acid

  • Molecular FormulaC22H36O3
  • Average mass348.519 Da
  • Monoisotopic mass348.266449 Da
  • ChemSpider ID74849731

  • Double-bond stereo - Double-bond stereo

More details:

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

11-{3,4-Dimethyl-5-[(1E)-1-penten-1-yl]-2-furyl}undecanoic acid [ACD/IUPAC Name]
11-{3,4-Dimethyl-5-[(1E)-1-penten-1-yl]-2-furyl}undecansäure [German] [ACD/IUPAC Name]
2-Furanundecanoic acid, 3,4-dimethyl-5-[(1E)-1-penten-1-yl]- [ACD/Index Name]
Acide 11-{3,4-diméthyl-5-[(1E)-1-pentén-1-yl]-2-furyl}undécanoïque [French] [ACD/IUPAC Name]
(E)-11-(3,4-dimethyl-5-(pent-1-en-1-yl)furan-2-yl)-undecanoic acid
11(E)-(3,4-dimethyl-5-(pent-1-en-1-yl)furan-2-yl)-undecanoic acid
11-{3,4-dimethyl-5-[(1E)-pent-1-en-1-yl]furan-2-yl}undecanoic acid
3,4-dimethyl-5-((E)pent-1-en-1-yl)-2-furanundecanoic acid

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: 476.0±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.9±3.0 kJ/mol
Flash Point: 241.7±27.3 °C
Index of Refraction: 1.510
Molar Refractivity: 106.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 8.50
ACD/LogD (pH 5.5): 6.21
ACD/BCF (pH 5.5): 19991.86
ACD/KOC (pH 5.5): 24764.05
ACD/LogD (pH 7.4): 4.42
ACD/BCF (pH 7.4): 320.71
ACD/KOC (pH 7.4): 397.26
Polar Surface Area: 50 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 37.1±3.0 dyne/cm
Molar Volume: 354.8±3.0 cm3

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