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4´-Methoxyacetophenone
ScientificNameLabel
4´-Methoxyacetophenone
PHCD compound ID :
1634
Chemical Names :
4-Methoxyace-tophenone , 4´-Methoxyacetophenone
Molecular Formula :
C9H10O2
Molecular Weight :
150.06808
More Details :
Names & Synonyms:
1-(4-methoxyphenyl)ethanone
Smiles:
COc1ccc(cc1)C(=O)C
InChi :
InChI=1S/C9H10O2/c1-7(10)8-3-5-9(11-2)6-4-8/h3-6H,1-2H3
InChi Key :
InChIKey=NTPLXRHDUXRPNE-UHFFFAOYSA-N
PubChem ID :
7476
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
2
Ionization potential :
9.305408
Hydrogen bond donor count :
0
Electric dipole moment :
3.087
XLogP :
0.851
VDW volume :
147.99848
Molecular weight :
150.06808
HOMO-LUMO gap :
8.911000
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'
184. Journal:'Rev. Bras. Farmacogn. Braz. J. Pharmacogn' Year:'2011' Volume:'21' Page:'407' DOI:'10.1590/S0102-695X2011005000030' Title:'Chemical composition and effect of an essential oil of Salix aegyptiaca (musk willow) in hypercholesterolemic rabbit model'
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