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1,4-hexadiene,3-ethyl-4, 5-dimethyl
PHCD compound ID : 116
Chemical Names :
1,4-hexadiene,3-ethyl-4, 5-dimethyl
Molecular Formula : C10H18
Molecular Weight : 138.140851
More Details :
Names & Synonyms: 3-ethyl-4,5-dimethyl-hexa-1,4-diene , 3-ethyl-4,5-dimethylhexa-1,4-diene
Smiles: CC[C@H](C(=C(C)C)C)C=C
InChi : InChI=1S/C10H18/c1-6-10(7-2)9(5)8(3)4/h6,10H,1,7H2,2-5H3/t10-/m1/s1
InChi Key : InChIKey=OICWWFVBYKPAIJ-SNVBAGLBSA-N
PubChem ID : 549148
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 0 Ionization potential : 8.911166
Hydrogen bond donor count : 0 Electric dipole moment : 0.617
XLogP : 4.284 VDW volume : 176.243388
Molecular weight : 138.140851 HOMO-LUMO gap : 10.044000
Herb list :
Refrences & Litretures:
  
6.      Journal:'Photochemistry and Photobiology'      Year:'2014'      Volume:'90'      Page:'702'      DOI:'10.1111/php.12229'      Title:'Biochemical Composition and Antioxidant Properties of Lavandula angustifolia Miller Essential Oil are Shielded by Propolis Against UV Radiations'
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