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4,5-dimethyl-2,6-octadiene
PHCD compound ID : 2942
Chemical Names :
4,5-dimethyl-2,6-octadiene
Molecular Formula : C10H18
Molecular Weight : 138.140851
More Details :
Names & Synonyms: 4,5-dimethylocta-2,6-diene
Smiles: C/C=C/[C@H]([C@H](/C=C/C)C)C
InChi : InChI=1S/C10H18/c1-5-7-9(3)10(4)8-6-2/h5-10H,1-4H3/b7-5+,8-6+/t9-,10+
InChi Key : InChIKey=JASAKDWEYSDIHI-NISHSBGLSA-N
PubChem ID : 519579
Rotatable bond count : 3 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 9.386894
Hydrogen bond donor count : 0 Electric dipole moment : 0.004
XLogP : 5.078 VDW volume : 176.243388
Molecular weight : 138.140851 HOMO-LUMO gap : 10.575000
Herb list :
Refrences & Litretures:
  
371.      Journal:'Pharmaceutical Crops'      Year:'2011'      Volume:'2'      Page:'28'      DOI:''      Title:'Chemical composition and product quality control of turmeric (Curcuma longa L.)'
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