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ScientificNameLabel
9-Eicosyne
PHCD compound ID : 2696
Chemical Names :
9-Eicosyne
Molecular Formula : C20H38
Molecular Weight : 278.297351
More Details :
Names & Synonyms: icos-9-yne , 9-eicosyne , eicos-9-yne
Smiles: CCCCCCCCCCC#CCCCCCCCC
InChi : InChI=1S/C20H38/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-17,19H2,1-2H3
InChi Key : InChIKey=ARULVMGJDAAVBD-UHFFFAOYSA-N
PubChem ID : 557019
Rotatable bond count : 14 Rule of five : 2
Hydrogen bond acceptor count : 0 Ionization potential : 9.886161
Hydrogen bond donor count : 0 Electric dipole moment : 0.426
XLogP : 10.51 VDW volume : 349.203234
Molecular weight : 278.297351 HOMO-LUMO gap : 11.742000
Herb list :
Refrences & Litretures:
  
312.      Journal:'Talanta'      Year:'2010'      Volume:'81'      Page:'129'      DOI:'10.1016/j.talanta.2009.11.047'      Title:'Identi?cation of Portulaca oleracea L. from different sources using GC–MS and FT-IR spectroscopy'
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