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Compound: 5546
Plants: 312
References: 992
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Alpha-Fenchocamphorone
ScientificNameLabel
Alpha-Fenchocamphorone
PHCD compound ID :
1682
Chemical Names :
Alpha-Fenchocamphorone
Molecular Formula :
C9H14O1
Molecular Weight :
138.104465
More Details :
Names & Synonyms:
7,7-dimethylnorbornan-2-one , 7,7-dimethyl-3-bicyclo[2.2.1]heptanone , 7,7-dimethylbicyclo[2.2.1]heptan-3-one
Smiles:
O=C1C[C@@H]2C([C@H]1CC2)(C)C
InChi :
InChI=1S/C9H14O/c1-9(2)6-3-4-7(9)8(10)5-6/h6-7H,3-5H2,1-2H3/t6-,7+/m1/s1
InChi Key :
InChIKey=DOCLMTQMWGMALI-RQJHMYQMSA-N
PubChem ID :
550030
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.829197
Hydrogen bond donor count :
0
Electric dipole moment :
3.437
XLogP :
1.926
VDW volume :
145.661171
Molecular weight :
138.104465
HOMO-LUMO gap :
10.847000
Herb list :
Colt's foot, Horse hoof - Tussilago farfara - پای خر
Refrences & Litretures:
190. Journal:'Journal of Essential Oil Bearing Plants' Year:'2011' Volume:'14' Page:'413' DOI:'' Title:'Volatile Oils of Flowers and Stems of Tussilago farfara L. from Lithuania'
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