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Ethyl,9-octadecenoate
PHCD compound ID : 3853
Chemical Names :
Ethyl 9-octadecenoate,(E) , Ethyl,9-octadecenoate , 9-Octadecenoic acid,ethyl ester
Molecular Formula : C20H38O2
Molecular Weight : 310.28718
More Details :
Names & Synonyms: ethyl (E)-octadec-9-enoate , (E)-9-octadecenoic acid ethyl ester , (E)-octadec-9-enoic acid ethyl ester
Smiles: CCCCCCCC/C=C/CCCCCCCC(=O)OCC
InChi : InChI=1S/C20H38O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20(21)22-4-2/h11-12H,3-10,13-19H2,1-2H3/b12-11+
InChi Key : InChIKey=LVGKNOAMLMIIKO-VAWYXSNFSA-N
PubChem ID : 5364430
Rotatable bond count : 17 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 9.516900
Hydrogen bond donor count : 0 Electric dipole moment : 1.609
XLogP : 8.936 VDW volume : 366.783687
Molecular weight : 310.28718 HOMO-LUMO gap : 10.763000
Herb list :
Refrences & Litretures:
  
519.      Journal:'International Journal of Technology Enhancements and Emerging Engineering Research'      Year:'2014'      Volume:'2'      Page:'120'      DOI:''      Title:'Chemical Composition And Antibacterial Activity Of The Essential Oil Isolated From Seinat (Cucumis Melo Var. Tibish) Seeds'
582.      Journal:'Food Chemistry'      Year:'2007'      Volume:'101'      Page:'1272'      DOI:'10.1016/j.foodchem.2005.12.029'      Title:'Flavour pro?le of capers (Capparis spinosa L.) from the Eolian Archipelago by HS-SPME/GC–MS'
703.      Journal:'BioMed Research International'      Year:'2013'      Volume:'2013'      Page:'1'      DOI:'10.1155/2013/696835'      Title:'Chemical Composition and Antibacterial and Cytotoxic Activities of Allium hirtifolium Boiss'
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