3',5'-Dihydroxyacetophenone

ScientificNameLabel

3',5'-Dihydroxyacetophenone
PHCD compound ID :	4122
Chemical Names :	3',5'-Dihydroxyacetophenone
Molecular Formula :	C8H8O3
Molecular Weight :	152.047344

More Details :

Names & Synonyms:	1-(3,5-dihydroxyphenyl)ethanone , 1-[3,5-bis(oxidanyl)phenyl]ethanone
Smiles:	CC(=O)c1cc(O)cc(c1)O
InChi :	InChI=1S/C8H8O3/c1-5(9)6-2-7(10)4-8(11)3-6/h2-4,10-11H,1H3
InChi Key :	InChIKey=WQXWIKCZNIGMAP-UHFFFAOYSA-N
PubChem ID :	103993

Rotatable bond count :	1	Rule of five :	0
Hydrogen bond acceptor count :	3	Ionization potential :	9.403166
Hydrogen bond donor count :	2	Electric dipole moment :	3.932
XLogP :	0.449	VDW volume :	139.492722
Molecular weight :	152.047344	HOMO-LUMO gap :	8.633000

Herb list :

Ziziphora - Ziziphora tenuior - کاکوتی

Refrences & Litretures:


575. Journal:'J. Chin. Chem. Soc' Year:'2013' Volume:'60' Page:'649' DOI:'10.1002/jccs.201300133' Title:'Improvement of GC-MS Analysis of Shahrbabak Ziziphora tenuior Essential Oil by Using Multivariate Curve Resolution Approaches'

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