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ScientificNameLabel
Sabinene hydrate-cis
PHCD compound ID : 187
Chemical Names :
Sabinene hydrate-cis
Molecular Formula : C10H18
Molecular Weight : 138.140851
More Details :
Names & Synonyms: (1S,4R)-1-isopropyl-4-methyl-bicyclo[3.1.0]hexane , (1S,4R)-4-methyl-1-propan-2-ylbicyclo[3.1.0]hexane , (1S,4R)-4-methyl-1-propan-2-yl-bicyclo[3.1.0]hexane
Smiles: C[C@@H]1CC[C@@]2([C@H]1C2)C(C)C
InChi : InChI=1S/C10H18/c1-7(2)10-5-4-8(3)9(10)6-10/h7-9H,4-6H2,1-3H3/t8-,9+,10+/m1/s1
InChi Key : InChIKey=GCTNBVHDRFKLLK-UTLUCORTSA-N
PubChem ID : 101629835
Rotatable bond count : 1 Rule of five : 1
Hydrogen bond acceptor count : 0 Ionization potential : 10.028104
Hydrogen bond donor count : 0 Electric dipole moment : 0.522
XLogP : 5.143 VDW volume : 156.803388
Molecular weight : 138.140851 HOMO-LUMO gap : 12.671000
Herb list :
Refrences & Litretures:
  
11.      Journal:'Analytica Chimica Acta'      Year:'2006'      Volume:'555'      Page:'157'      DOI:'10.1016/j.aca.2005.08.071'      Title:'Microwave accelerated steam distillation of essential oil from lavender: A rapid, clean and environmentally friendly approach'
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