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Compound: 5546
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References: 992
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(E,Z)-2,6-Nonadienol
ScientificNameLabel
(E,Z)-2,6-Nonadienol
PHCD compound ID :
3086
Chemical Names :
(E,Z)-2,6-Nonadienol
Molecular Formula :
C9H16O1
Molecular Weight :
140.120115
More Details :
Names & Synonyms:
(2E,6Z)-nona-2,6-dien-1-ol , (2E,6Z)-1-nona-2,6-dienol
Smiles:
CC/C=C\CC/C=C/CO
InChi :
InChI=1S/C9H16O/c1-2-3-4-5-6-7-8-9-10/h3-4,7-8,10H,2,5-6,9H2,1H3/b4-3-,8-7+
InChi Key :
InChIKey=AMXYRHBJZOVHOL-ODYTWBPASA-N
PubChem ID :
5362833
Rotatable bond count :
5
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.650968
Hydrogen bond donor count :
1
Electric dipole moment :
2.393
XLogP :
2.864
VDW volume :
167.73763
Molecular weight :
140.120115
HOMO-LUMO gap :
10.494000
Herb list :
Cacao tree - Theobroma cacao - کاکائو
Olive - Olea europaea - زیتون
Refrences & Litretures:
399. Journal:'Journal of Food, Agriculture & Environment' Year:'2010' Volume:'8' Page:'204' DOI:'' Title:'Pharmacological activities and chemical composition of the Olea europaea L. leaf essential oils from Tunisia'
568. Journal:'J. Essent. Oil Res' Year:'2005' Volume:'17' Page:'312' DOI:'' Title:'Essential Oils in the Leaves of Cocoa (Theobroma cacao L.) Clone UIT1 and NA33'
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