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ScientificNameLabel
6-Ethyl-2-methyloctane
PHCD compound ID : 5493
Chemical Names :
6-Ethyl-2-methyloctane
Molecular Formula : C11H24
Molecular Weight : 156.187801
More Details :
Names & Synonyms: 6-ethyl-2-methyl-octane , 6-ethyl-2-methyloctane
Smiles: CCC(CCCC(C)C)CC
InChi : InChI=1S/C11H24/c1-5-11(6-2)9-7-8-10(3)4/h10-11H,5-9H2,1-4H3
InChi Key : InChIKey=AZXGABNJUBNOHW-UHFFFAOYSA-N
PubChem ID : 537768
Rotatable bond count : 6 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 10.682348
Hydrogen bond donor count : 0 Electric dipole moment : 0.147
XLogP : 6.477 VDW volume : 198.81229
Molecular weight : 156.187801 HOMO-LUMO gap : 14.621000
Herb list :
Refrences & Litretures:
  
922.      Journal:'Acta Physiol Plant'      Year:'2010'      Volume:'32'      Page:'231'      DOI:'10.1007/s11738-009-0381-5'      Title:'Essential oil composition of Taraxacum of?cinale'
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