5-Hexene-2-one

ScientificNameLabel

5-Hexene-2-one
PHCD compound ID :	4587
Chemical Names :	5-Hexene-2-one
Molecular Formula :	C6H10O1
Molecular Weight :	98.073165

More Details :

Names & Synonyms:	hex-5-en-2-one , 5-hexen-2-one
Smiles:	C=CCCC(=O)C
InChi :	InChI=1S/C6H10O/c1-3-4-5-6(2)7/h3H,1,4-5H2,2H3
InChi Key :	InChIKey=RNDVGJZUHCKENF-UHFFFAOYSA-N
PubChem ID :	7989

Rotatable bond count :	3	Rule of five :	0
Hydrogen bond acceptor count :	1	Ionization potential :	10.104086
Hydrogen bond donor count :	0	Electric dipole moment :	3.055
XLogP :	1.21	VDW volume :	115.849676
Molecular weight :	98.073165	HOMO-LUMO gap :	10.959000

Herb list :

Clove - Syzygium aromaticum - میخک، میخک صدپر

Refrences & Litretures:


710. Journal:'Rev. Latinoamer. Qu?m' Year:'2007' Volume:'35' Page:'47' DOI:'' Title:'Chemical Constituents of Clove (Syzygium aromaticum, Fam. Myrtaceae) and their Antioxidant Activity'

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