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ScientificNameLabel
3-Thujen-2-ol
PHCD compound ID : 363
Chemical Names :
3-Thujen-2-ol
Molecular Formula : C10H16O1
Molecular Weight : 152.120115
More Details :
Names & Synonyms: 1-isopropyl-4-methyl-bicyclo[3.1.0]hex-3-en-2-ol , 4-methyl-1-propan-2-yl-2-bicyclo[3.1.0]hex-3-enol , 4-methyl-1-propan-2-ylbicyclo[3.1.0]hex-3-en-2-ol , 4-methyl-1-propan-2-yl-bicyclo[3.1.0]hex-3-en-2-ol
Smiles: CC1=C[C@@H]([C@]2([C@@H]1C2)C(C)C)O
InChi : InChI=1S/C10H16O/c1-6(2)10-5-8(10)7(3)4-9(10)11/h4,6,8-9,11H,5H2,1-3H3/t8-,9+,10+/m1/s1
InChi Key : InChIKey=OJTQGSSVGDYALN-UTLUCORTSA-N
PubChem ID : 561871
Rotatable bond count : 1 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.572145
Hydrogen bond donor count : 1 Electric dipole moment : 2.391
XLogP : 1.936 VDW volume : 162.957156
Molecular weight : 152.120115 HOMO-LUMO gap : 10.272000
Herb list :
Refrences & Litretures:
  
22.      Journal:'Z Lebensm Unters Forsch A'      Year:'1999'      Volume:'208'      Page:'212'      DOI:''      Title:'Effect of extraction techniques on the chemical composition and antioxidant activity of Eucalyptus camaldulensis var. brevirostris leaf oils'
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