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Cyclohexanol
ScientificNameLabel
Cyclohexanol
PHCD compound ID :
5508
Chemical Names :
Cyclohexanol
Molecular Formula :
C6H12O1
Molecular Weight :
100.088815
More Details :
Names & Synonyms:
cyclohexanol
Smiles:
OC1CCCCC1
InChi :
InChI=1S/C6H12O/c7-6-4-2-1-3-5-6/h6-7H,1-5H2
InChi Key :
InChIKey=HPXRVTGHNJAIIH-UHFFFAOYSA-N
PubChem ID :
7966
Rotatable bond count :
0
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
10.365827
Hydrogen bond donor count :
1
Electric dipole moment :
1.932
XLogP :
1.329
VDW volume :
108.766134
Molecular weight :
100.088815
HOMO-LUMO gap :
13.275000
Herb list :
Globe thistle - Echinops robustus - شکرتیغال غول آسا
Refrences & Litretures:
923. Journal:'Letters in Applied NanoBioScience' Year:'2020' Volume:'9' Page:'849' DOI:'10.33263/LIANBS91.849852' Title:'Chemical composition and antibacterial activity of methanolic extract from Echinops robustus on typical food-borne pathogens'
Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.
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