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4,8-Dimethyl-7-nonen-2-one
ScientificNameLabel
4,8-Dimethyl-7-nonen-2-one
PHCD compound ID :
381
Chemical Names :
4,8-Dimethyl-7-nonen-2-one
Molecular Formula :
C11H20O1
Molecular Weight :
168.151415
More Details :
Names & Synonyms:
4,8-dimethylnon-7-en-2-one , 4,8-dimethyl-7-nonen-2-one
Smiles:
CC(=CCC[C@@H](CC(=O)C)C)C
InChi :
InChI=1S/C11H20O/c1-9(2)6-5-7-10(3)8-11(4)12/h6,10H,5,7-8H2,1-4H3/t10-/m0/s1
InChi Key :
InChIKey=IWFZTPMBJHEUFV-JTQLQIEISA-N
PubChem ID :
19316
Rotatable bond count :
5
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.222188
Hydrogen bond donor count :
0
Electric dipole moment :
2.699
XLogP :
3.442
VDW volume :
202.329599
Molecular weight :
168.151415
HOMO-LUMO gap :
10.177000
Herb list :
Eucalyptus, River red gum - Eucalyptus camaldulensis - اكاليپتوس
Refrences & Litretures:
22. Journal:'Z Lebensm Unters Forsch A' Year:'1999' Volume:'208' Page:'212' DOI:'' Title:'Effect of extraction techniques on the chemical composition and antioxidant activity of Eucalyptus camaldulensis var. brevirostris leaf oils'
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