Found 1 result

Search term: CCPPLLJZDQAOHD-FLIBITNWSA-M (Found by InChIKey (full match))
ChemSpider 2D Image | (9Z)-11-(3-Pentyl-2-oxiranyl)-9-undecenoate | C18H31O3

(9Z)-11-(3-Pentyl-2-oxiranyl)-9-undecenoate

  • Molecular FormulaC18H31O3
  • Average mass295.438 Da
  • Monoisotopic mass295.227875 Da
  • ChemSpider ID34448932

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

(9Z)-11-(3-Pentyl-2-oxiranyl)-9-undecenoat [German] [ACD/IUPAC Name]
(9Z)-11-(3-Pentyl-2-oxiranyl)-9-undecenoate [ACD/IUPAC Name]
(9Z)-11-(3-Pentyl-2-oxiranyl)-9-undécénoate [French] [ACD/IUPAC Name]
9-Undecenoic acid, 11-(3-pentyloxiranyl)-, ion(1-), (9Z)- [ACD/Index Name]
(9Z)-(12S,13R)-12,13-Epoxyoctadecenoic acid
(9Z)-11-(3-pentyloxiran-2-yl)undec-9-enoate
12,13-EpOME(1-)
12,13-epoxy-(9Z)-octadecenoate
cis-12,13-Epoxy-cis-9-octadecenoic acid
Vernolate [BSI] [ISO]
More...
  • Miscellaneous

    • Chemical Class:

      A monounsaturated fatty acid anion that is the conjugate base of vernolic acid, obtained by deprotonation of the carboxy group; major species at pH 7.3. ChEBI CHEBI:84026

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

Density:
Boiling Point: 395.8±15.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 70.9±6.0 kJ/mol
Flash Point: 130.0±13.9 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 5.89
ACD/LogD (pH 5.5): 4.87
ACD/BCF (pH 5.5): 1910.41
ACD/KOC (pH 5.5): 4607.02
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 30.63
ACD/KOC (pH 7.4): 73.87
Polar Surface Area: 53 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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