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ScientificNameLabel
(2Z)-Heptenyl acetate
PHCD compound ID : 4467
Chemical Names :
(2Z)-Heptenyl acetate
Molecular Formula : C9H16O2
Molecular Weight : 156.11503
More Details :
Names & Synonyms:
Smiles: CCCC/C=C\COC(=O)C
InChi : InChI=1S/C9H16O2/c1-3-4-5-6-7-8-11-9(2)10/h6-7H,3-5,8H2,1-2H3/b7-6-
InChi Key : InChIKey=AWCPMVVOGVEPRC-SREVYHEPSA-N
PubChem ID :
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.840764
Hydrogen bond donor count : 0 Electric dipole moment : 1.663
XLogP : 2.982 VDW volume : 176.527856
Molecular weight : 156.11503 HOMO-LUMO gap : 10.784000
Herb list :
Refrences & Litretures:
  
659.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'37'      Page:'479'      DOI:'10.1016/j.indcrop.2011.07.024'      Title:'Chemical composition and antioxidant and antimicrobial activity of essential oil of Artemisia annua L. from Bosnia'
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