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Search term: 113368245 (Found by CSID)
ChemSpider 2D Image | (9Z)-9-Octadecene-12,14,16-triynoic acid | C18H22O2

(9Z)-9-Octadecene-12,14,16-triynoic acid

  • Molecular FormulaC18H22O2
  • Average mass270.366 Da
  • Monoisotopic mass270.161987 Da
  • ChemSpider ID113368245

  • Double-bond stereo - Double-bond stereo

More details:

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

(9Z)-9-Octadecen-12,14,16-triinsäure [German] [ACD/IUPAC Name]
(9Z)-9-Octadecene-12,14,16-triynoic acid [ACD/IUPAC Name]
9-Octadecene-12,14,16-triynoic acid, (9Z)- [ACD/Index Name]
Acide (9Z)-9-octadécène-12,14,16-triynoïque [French] [ACD/IUPAC Name]
(Z)-octadeca-9-en-12,14,16-triynoic acid
Octadeca-9-en-12,14,16-triynoic 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: 399.9±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 71.4±6.0 kJ/mol
Flash Point: 191.9±23.1 °C
Index of Refraction: 1.527
Molar Refractivity: 81.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 7.40
ACD/LogD (pH 5.5): 4.96
ACD/BCF (pH 5.5): 2238.44
ACD/KOC (pH 5.5): 5158.33
ACD/LogD (pH 7.4): 3.17
ACD/BCF (pH 7.4): 35.89
ACD/KOC (pH 7.4): 82.70
Polar Surface Area: 37 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 47.3±3.0 dyne/cm
Molar Volume: 263.8±3.0 cm3

Click to predict properties on the Chemicalize site


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