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ScientificNameLabel
Dehydrogeosmin
PHCD compound ID : 2701
Chemical Names :
Dehydrogeosmin
Molecular Formula : C12H20O1
Molecular Weight : 180.151415
More Details :
Names & Synonyms: (4S,4aS,8aS)-4,8a-dimethyl-1,2,3,4,5,8-hexahydronaphthalen-4a-ol
Smiles: C[C@H]1CCC[C@@]2([C@]1(O)CC=CC2)C
InChi : InChI=1S/C12H20O/c1-10-6-5-8-11(2)7-3-4-9-12(10,11)13/h3-4,10,13H,5-9H2,1-2H3/t10-,11+,12-/m0/s1
InChi Key : InChIKey=COFTVDLZYIBNEL-TUAOUCFPSA-N
PubChem ID : 11084487
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.345555
Hydrogen bond donor count : 1 Electric dipole moment : 1.996
XLogP : 2.806 VDW volume : 197.549125
Molecular weight : 180.151415 HOMO-LUMO gap : 10.816000
Herb list :
Refrences & Litretures:
  
314.      Journal:'Journal of Essential Oil Bearing Plants'      Year:'2012'      Volume:'15'      Page:'373'      DOI:'10.1080/0972060X.2012.10644063'      Title:'Chemical Composition and Antimicrobial Activity of the Essential Oil of Verbascum thapsus L'
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