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ScientificNameLabel
Ethyl pentadecanoate
PHCD compound ID : 3854
Chemical Names :
Pentadecanoic acid,ethyl ester , Ethyl pentadecanoate
Molecular Formula : C17H34O2
Molecular Weight : 270.25588
More Details :
Names & Synonyms: ethyl pentadecanoate , pentadecanoic acid ethyl ester
Smiles: CCCCCCCCCCCCCCC(=O)OCC
InChi : InChI=1S/C17H34O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17(18)19-4-2/h3-16H2,1-2H3
InChi Key : InChIKey=PTEYJUIKYIKULL-UHFFFAOYSA-N
PubChem ID : 38762
Rotatable bond count : 15 Rule of five : 2
Hydrogen bond acceptor count : 2 Ionization potential : 10.714944
Hydrogen bond donor count : 0 Electric dipole moment : 1.966
XLogP : 7.745 VDW volume : 317.532192
Molecular weight : 270.25588 HOMO-LUMO gap : 11.908000
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'
749.      Journal:'J. Agric. food Chem'      Year:'1983'      Volume:'31'      Page:'38'      DOI:'10.1021/jf00115a010'      Title:'Composition of the Essential Oil of Alfalfa'
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