ChemSpider 2D Image | (8E)-9-[(1Z,3Z,6Z)-1,3,6-Nonatrien-1-yloxy]-8-nonenoic acid | C18H28O3

(8E)-9-[(1Z,3Z,6Z)-1,3,6-Nonatrien-1-yloxy]-8-nonenoic acid

  • Molecular FormulaC18H28O3
  • Average mass292.413 Da
  • Monoisotopic mass292.203857 Da
  • ChemSpider ID115266905

  • Double-bond stereo - Double-bond stereo

More details:

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

(8E)-9-[(1Z,3Z,6Z)-1,3,6-Nonatrien-1-yloxy]-8-nonenoic acid [ACD/IUPAC Name]
(8E)-9-[(1Z,3Z,6Z)-1,3,6-Nonatrien-1-yloxy]-8-nonensäure [German] [ACD/IUPAC Name]
8-Nonenoic acid, 9-[(1Z,3Z,6Z)-1,3,6-nonatrien-1-yloxy]-, (8E)- [ACD/Index Name]
Acide (8E)-9-[(1Z,3Z,6Z)-1,3,6-nonatrién-1-yloxy]-8-nonénoïque [French] [ACD/IUPAC Name]
(1'Z)Colnelenic acid
9-[1'Z,3'Z,6'Z-trien-1'-yloxy]-non-8E-enoic acid

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

Density: 1.0±0.1 g/cm3
Boiling Point: 446.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 77.2±6.0 kJ/mol
Flash Point: 152.7±22.2 °C
Index of Refraction: 1.503
Molar Refractivity: 89.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 4.28
ACD/LogD (pH 5.5): 3.75
ACD/BCF (pH 5.5): 266.46
ACD/KOC (pH 5.5): 1119.92
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 4.27
ACD/KOC (pH 7.4): 17.93
Polar Surface Area: 47 Å2
Polarizability: 35.3±0.5 10-24cm3
Surface Tension: 36.2±3.0 dyne/cm
Molar Volume: 301.1±3.0 cm3

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