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ScientificNameLabel
Rhodinol
PHCD compound ID : 3104
Chemical Names :
Rhodinol
Molecular Formula : C10H20O1
Molecular Weight : 156.151415
More Details :
Names & Synonyms: (3S)-3,7-dimethyloct-7-en-1-ol , (3S)-3,7-dimethyl-7-octen-1-ol
Smiles: OCC[C@H](CCCC(=C)C)C
InChi : InChI=1S/C10H20O/c1-9(2)5-4-6-10(3)7-8-11/h10-11H,1,4-8H2,2-3H3/t10-/m0/s1
InChi Key : InChIKey=JGQFVRIQXUFPAH-JTQLQIEISA-N
PubChem ID : 81263
Rotatable bond count : 6 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.739803
Hydrogen bond donor count : 1 Electric dipole moment : 2.036
XLogP : 3.331 VDW volume : 187.670073
Molecular weight : 156.151415 HOMO-LUMO gap : 10.977000
Herb list :
Refrences & Litretures:
  
410.      Journal:'Food Chemistry'      Year:'2009'      Volume:'115'      Page:'1114'      DOI:'10.1016/j.foodchem.2008.12.091'      Title:'Extraction of Cuminum cyminum essential oil by combination technology of organic solvent with low boiling point and steam distillation'
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