ChemSpider 2D Image | (5E,9Z)-9-(2-Hexadecylcyclopropylidene)-5-nonenoic acid | C28H50O2

(5E,9Z)-9-(2-Hexadecylcyclopropylidene)-5-nonenoic acid

  • Molecular FormulaC28H50O2
  • Average mass418.695 Da
  • Monoisotopic mass418.381073 Da
  • ChemSpider ID57514462
  • Double-bond stereo - Double-bond stereo


More details:






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

(5E,9Z)-9-(2-Hexadecylcyclopropyliden)-5-nonensäure [German] [ACD/IUPAC Name]
(5E,9Z)-9-(2-Hexadecylcyclopropylidene)-5-nonenoic acid [ACD/IUPAC Name]
5-Nonenoic acid, 9-(2-hexadecylcyclopropylidene)-, (5E,9Z)- [ACD/Index Name]
Acide (5E,9Z)-9-(2-hexadécylcyclopropylidène)-5-nonénoïque [French] [ACD/IUPAC Name]
9-(2-HEXADECYLCYCLOPROPYLIDENE)NON-5-ENOIC ACID

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

Density: 0.9±0.1 g/cm3
Boiling Point: 515.8±19.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 86.2±6.0 kJ/mol
Flash Point: 412.3±16.6 °C
Index of Refraction: 1.512
Molar Refractivity: 133.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 1
ACD/LogP: 11.77
ACD/LogD (pH 5.5): 10.17
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 3455116.00
ACD/LogD (pH 7.4): 8.37
ACD/BCF (pH 7.4): 321367.09
ACD/KOC (pH 7.4): 55222.97
Polar Surface Area: 37 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 442.9±3.0 cm3

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