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Compound: 5546
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References: 992
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1,5,7-Octatrien-3-ol
ScientificNameLabel
1,5,7-Octatrien-3-ol
PHCD compound ID :
4775
Chemical Names :
1,5,7-Octatrien-3-ol
Molecular Formula :
C8H12O1
Molecular Weight :
124.088815
More Details :
Names & Synonyms:
Smiles:
C=C/C=C/C[C@@H](C=C)O
InChi :
InChI=1S/C8H12O/c1-3-5-6-7-8(9)4-2/h3-6,8-9H,1-2,7H2/b6-5+/t8-/m1/s1
InChi Key :
InChIKey=VDZVLUMVRXPKNF-HQZHTGGTSA-N
PubChem ID :
Rotatable bond count :
4
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.276667
Hydrogen bond donor count :
1
Electric dipole moment :
1.769
XLogP :
1.897
VDW volume :
147.805186
Molecular weight :
124.088815
HOMO-LUMO gap :
9.453000
Herb list :
True lavender - Lavandula officinalis - اسطوخودوس
Refrences & Litretures:
760. Journal:'International Journal of ChemTech Research' Year:'2014' Volume:'6' Page:'4918' DOI:'' Title:'Chemical composition and fungitoxic activities of Lavandula officinalis L. oil and comparison with synthetic fungicide on the growth some fungi in vitro'
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