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ScientificNameLabel
alpha-terpineol acetate
PHCD compound ID : 1545
Chemical Names :
alpha-terpineol acetate
Molecular Formula : C12H20O2
Molecular Weight : 196.14633
More Details :
Names & Synonyms: [1-methyl-1-[(1R)-4-methylcyclohex-3-en-1-yl]ethyl] acetate , acetic acid 2-[(1R)-4-methyl-1-cyclohex-3-enyl]propan-2-yl ester , 2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl acetate , 2-[(1R)-4-methylcyclohex-3-en-1-yl]propan-2-yl ethanoate , acetic acid [1-methyl-1-[(1R)-4-methylcyclohex-3-en-1-yl]ethyl] ester
Smiles: CC(=O)OC([C@@H]1CCC(=CC1)C)(C)C
InChi : InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h5,11H,6-8H2,1-4H3/t11-/m0/s1
InChi Key : InChIKey=IGODOXYLBBXFDW-NSHDSACASA-N
PubChem ID : 11469649
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.161072
Hydrogen bond donor count : 0 Electric dipole moment : 2.193
XLogP : 3.109 VDW volume : 216.059352
Molecular weight : 196.14633 HOMO-LUMO gap : 10.483000
Herb list :
Refrences & Litretures:
  
170.      Journal:'J. Crop Prot'      Year:'2012'      Volume:'1'      Page:'313'      DOI:''      Title:'Chemical composition and insecticide activity of lemon verbena essential oil'
847.      Journal:'ORIENTAL JOURNAL OF CHEMISTRY'      Year:'2016'      Volume:'32'      Page:'331'      DOI:'10.13005/ojc/320137'      Title:'A Comparative Study of the Chemical Composition of the Essential oil from Eucalyptus globulus Growing in Dehradun (india) and Around the World'
849.      Journal:'Biological Forum – An International Journal'      Year:'2015'      Volume:'7'      Page:'322'      DOI:''      Title:'Chemical Composition of Eucalyptus globulus grown in Iran'
899.      Journal:'Biochemical Systematics and Ecology'      Year:'2008'      Volume:'36'      Page:'360'      DOI:'10.1016/j.bse.2007.12.003'      Title:'Antimicrobial and insecticidal activities of essential oil isolated from Turkish Salvia hydrangea DC. ex Benth'
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