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ScientificNameLabel
1,9-Nonanediol
PHCD compound ID : 5494
Chemical Names :
1,9-Nonanediol
Molecular Formula : C9H20O2
Molecular Weight : 160.14633
More Details :
Names & Synonyms: nonane-1,9-diol
Smiles: OCCCCCCCCCO
InChi : InChI=1S/C9H20O2/c10-8-6-4-2-1-3-5-7-9-11/h10-11H,1-9H2
InChi Key : InChIKey=ALVZNPYWJMLXKV-UHFFFAOYSA-N
PubChem ID : 19835
Rotatable bond count : 8 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 10.575293
Hydrogen bond donor count : 2 Electric dipole moment : 2.298
XLogP : 1.931 VDW volume : 181.800774
Molecular weight : 160.14633 HOMO-LUMO gap : 13.396000
Herb list :
Refrences & Litretures:
  
922.      Journal:'Acta Physiol Plant'      Year:'2010'      Volume:'32'      Page:'231'      DOI:'10.1007/s11738-009-0381-5'      Title:'Essential oil composition of Taraxacum of?cinale'
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