1,2-Cyclohexan-edione

ScientificNameLabel

1,2-Cyclohexan-edione
PHCD compound ID :	1626
Chemical Names :	1,2-Cyclohexan-edione
Molecular Formula :	C6H8O2
Molecular Weight :	112.052429

More Details :

Names & Synonyms:	cyclohexane-1,2-dione , cyclohexane-1,2-quinone
Smiles:	O=C1CCCCC1=O
InChi :	InChI=1S/C6H8O2/c7-5-3-1-2-4-6(5)8/h1-4H2
InChi Key :	InChIKey=OILAIQUEIWYQPH-UHFFFAOYSA-N
PubChem ID :	13006

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.717745
Hydrogen bond donor count :	0	Electric dipole moment :	4.785
XLogP :	0.002	VDW volume :	112.283444
Molecular weight :	112.052429	HOMO-LUMO gap :	9.592000

Herb list :

Egyptian willow - Salix aegyptiaca - بيدمشك

Refrences & Litretures:


183. Journal:'Journal of Essential Oil Bearing Plants' Year:'2011' Volume:'14' Page:'543' DOI:'10.1080/0972060X.2011.10643971' Title:'Chemical Compositions of Salix aegyptiaca. L. Obtained by Simultaneous Hydrodistilation and Extraction'

Copyright © 2017, Chemistry and Chemical Engineering Research Center of Iran. All rights reserved.

Follow us