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Compound: 5546
Plants: 312
References: 992
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Cyclohexanone
ScientificNameLabel
Cyclohexanone
PHCD compound ID :
1163
Chemical Names :
Cyclohexanoine , Cyclohexanone
Molecular Formula :
C6H10O1
Molecular Weight :
98.073165
More Details :
Names & Synonyms:
cyclohexanone
Smiles:
O=C1CCCCC1
InChi :
InChI=1S/C6H10O/c7-6-4-2-1-3-5-6/h1-5H2
InChi Key :
InChIKey=JHIVVAPYMSGYDF-UHFFFAOYSA-N
PubChem ID :
7967
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.922430
Hydrogen bond donor count :
0
Electric dipole moment :
3.468
XLogP :
0.92
VDW volume :
106.129676
Molecular weight :
98.073165
HOMO-LUMO gap :
10.890000
Herb list :
Great plantain, Waybread - Plantago major - بارهنگ كبير، بارهنگ
Ornamental rhubarb, Chinese rhubarb - Rheum palmatum L - روبارب، ریواس چینی، ریوند
Oxtongue flower - Echium amoenum - گل گاو زبان
Tea - Camellia sinensis - چای
Refrences & Litretures:
119. Journal:'World Appl. Sci. J' Year:'2011' Volume:'17' Page:'67' DOI:'' Title:'GC-MS Analysis of Various Extracts from Leaf of Plantago major Used as Traditional Medicine'
644. Journal:'Int. J. Biosci' Year:'2015' Volume:'6' Page:'156' DOI:'' Title:'Essential oil constituents and fatty acids in Echium amoenum grown wild in Iran'
814. Journal:'Natural Products: An Indian Journal' Year:'2013' Volume:'9' Page:'16' DOI:'' Title:'Comparison investigation of essential oils in tea (Camellia sinensis L.var. sinensis) clones'
888. Journal:'FLAVOUR AND FRAGRANCE JOURNAL' Year:'1996' Volume:'11' Page:'57' DOI:'10.1002/(SICI)1099-1026(199601)11:1<57::AID-FFJ549>3.0.CO;2-K' Title:'Volatile Components of the Rhizomes of Rheum palmatum L'
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