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o-Menthan-3-one
ScientificNameLabel
o-Menthan-3-one
PHCD compound ID :
379
Chemical Names :
o-Menthan-3-one
Molecular Formula :
C10H18O1
Molecular Weight :
154.135765
More Details :
Names & Synonyms:
2-isopropyl-3-methyl-cyclohexanone , 3-methyl-2-propan-2-yl-1-cyclohexanone , 3-methyl-2-propan-2-ylcyclohexan-1-one , 3-methyl-2-propan-2-yl-cyclohexan-1-one
Smiles:
CC([C@@H]1[C@@H](C)CCCC1=O)C
InChi :
InChI=1S/C10H18O/c1-7(2)10-8(3)5-4-6-9(10)11/h7-8,10H,4-6H2,1-3H3/t8-,10+/m0/s1
InChi Key :
InChIKey=VMRPTQYLPHRYQR-WCBMZHEXSA-N
PubChem ID :
228306
Rotatable bond count :
1
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.696200
Hydrogen bond donor count :
0
Electric dipole moment :
3.330
XLogP :
2.798
VDW volume :
175.313614
Molecular weight :
154.135765
HOMO-LUMO gap :
10.769000
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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