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ScientificNameLabel
4-Hydroxy-delta-8-p-menthen-3-one
PHCD compound ID : 1903
Chemical Names :
4-Hydroxy-delta-8-p-menthen-3-one
Molecular Formula : C10H16O2
Molecular Weight : 168.11503
More Details :
Names & Synonyms:
Smiles: C[C@@H]1CC[C@@](C(=O)C1)(O)C(=C)C
InChi : InChI=1S/C10H16O2/c1-7(2)10(12)5-4-8(3)6-9(10)11/h8,12H,1,4-6H2,2-3H3/t8-,10-/m1/s1
InChi Key : InChIKey=AALYQEIWIWMEAJ-PSASIEDQSA-N
PubChem ID :
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.673014
Hydrogen bond donor count : 1 Electric dipole moment : 3.810
XLogP : 1.201 VDW volume : 181.467382
Molecular weight : 168.11503 HOMO-LUMO gap : 10.461000
Herb list :
Refrences & Litretures:
  
224.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'36'      Page:'81'      DOI:'10.1016/j.indcrop.2011.08.011'      Title:'European pennyroyal (Mentha pulegium) from Portugal: Chemical composition of essential oil and antioxidant and antimicrobial properties of extracts and essential oil'
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