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ScientificNameLabel
2-Ethyl menthone
PHCD compound ID : 1688
Chemical Names :
2-Ethyl menthone
Molecular Formula : C12H22O1
Molecular Weight : 182.167065
More Details :
Names & Synonyms:
Smiles: CC[C@H]1[C@H](C)CC[C@@H](C1=O)C(C)C
InChi : InChI=1S/C12H22O/c1-5-10-9(4)6-7-11(8(2)3)12(10)13/h8-11H,5-7H2,1-4H3/t9-,10+,11-/m1/s1
InChi Key : InChIKey=VXGVKPGULBZBOZ-OUAUKWLOSA-N
PubChem ID :
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.556949
Hydrogen bond donor count : 0 Electric dipole moment : 3.148
XLogP : 3.66 VDW volume : 209.905584
Molecular weight : 182.167065 HOMO-LUMO gap : 10.661000
Herb list :
Refrences & Litretures:
  
190.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2011'      Volume:'14'      Page:'413'      DOI:''      Title:'Volatile Oils of Flowers and Stems of Tussilago farfara L. from Lithuania'
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