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Cyclohexane
ScientificNameLabel
Cyclohexane
PHCD compound ID :
3650
Chemical Names :
Cyclohexane
Molecular Formula :
C6H12
Molecular Weight :
84.0939
More Details :
Names & Synonyms:
cyclohexane
Smiles:
C1CCCCC1
InChi :
InChI=1S/C6H12/c1-2-4-6-5-3-1/h1-6H2
InChi Key :
InChIKey=XDTMQSROBMDMFD-UHFFFAOYSA-N
PubChem ID :
8078
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
0
Ionization potential :
10.812628
Hydrogen bond donor count :
0
Electric dipole moment :
0.000
XLogP :
3.414
VDW volume :
99.975908
Molecular weight :
84.0939
HOMO-LUMO gap :
14.944000
Herb list :
Pockspray - Cotoneaster nummularioides - شیرخشت، سیاه چوب
Refrences & Litretures:
510. Journal:'Int. J. Biosci' Year:'2015' Volume:'6' Page:'357' DOI:'10.12692/ijb/6.2.357-365' Title:'Antibacterial effects and chemical composition of essential oils from Cotoneaster nummularioides pojark and Sonchus arvensis L. leaves extracts on typical food-borne pathogens'
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