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ScientificNameLabel
1-Oct-3-enyl acetate
PHCD compound ID : 4622
Chemical Names :
1-Oct-3-enyl acetate
Molecular Formula : C10H18O2
Molecular Weight : 170.13068
More Details :
Names & Synonyms: [(E)-oct-3-enyl] acetate , acetic acid [(E)-oct-3-enyl] ester , [(E)-oct-3-enyl] ethanoate
Smiles: CCCC/C=C/CCOC(=O)C
InChi : InChI=1S/C10H18O2/c1-3-4-5-6-7-8-9-12-10(2)11/h6-7H,3-5,8-9H2,1-2H3/b7-6+
InChi Key : InChIKey=PHXNWSHRRVPWLO-VOTSOKGWSA-N
PubChem ID : 5363205
Rotatable bond count : 7 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.574687
Hydrogen bond donor count : 0 Electric dipole moment : 1.891
XLogP : 3.351 VDW volume : 193.823841
Molecular weight : 170.13068 HOMO-LUMO gap : 10.749000
Herb list :
Refrences & Litretures:
  
716.      Journal:'Int. J. Electrochem. Sci'      Year:'2011'      Volume:'6'      Page:'691'      DOI:''      Title:'Chemical Composition and Inhibitory Effect of Mentha Spicata Essential Oil on the Corrosion of Steel in Molar Hydrochloric Acid'
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