1,2-Cyclopentanedione

ScientificNameLabel

1,2-Cyclopentanedione
PHCD compound ID :	5064
Chemical Names :	1,2-Cyclopentanedione
Molecular Formula :	C5H6O2
Molecular Weight :	98.036779

More Details :

Names & Synonyms:	cyclopentane-1,2-dione , cyclopentane-1,2-quinone
Smiles:	O=C1CCCC1=O
InChi :	InChI=1S/C5H6O2/c6-4-2-1-3-5(4)7/h1-3H2
InChi Key :	InChIKey=CIISBNCSMVCNIP-UHFFFAOYSA-N
PubChem ID :	566657

Rotatable bond count :	0	Rule of five :	0
Hydrogen bond acceptor count :	2	Ionization potential :	9.759155
Hydrogen bond donor count :	0	Electric dipole moment :	4.784
XLogP :	-0.356	VDW volume :	94.987459
Molecular weight :	98.036779	HOMO-LUMO gap :	9.231000

Herb list :

Onoin - Allium cepa - پیاز

Refrences & Litretures:


786. Journal:'Journal of Food Quality' Year:'2017' Volume:'' Page:'6873651' DOI:'10.1155/2017/6873651' Title:'Chemical Composition and Antioxidant Properties of Five White Onion (Allium cepa L.) Landraces'

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