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Compound: 5546
Plants: 312
References: 992
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P-Ethylacetophenone
ScientificNameLabel
P-Ethylacetophenone
PHCD compound ID :
5526
Chemical Names :
P-Ethylacetophenone
Molecular Formula :
C10H12O1
Molecular Weight :
148.088815
More Details :
Names & Synonyms:
1-(4-ethylphenyl)ethanone
Smiles:
CCc1ccc(cc1)C(=O)C
InChi :
InChI=1S/C10H12O/c1-3-9-4-6-10(7-5-9)8(2)11/h4-7H,3H2,1-2H3
InChi Key :
InChIKey=NODGRWCMFMEGJH-UHFFFAOYSA-N
PubChem ID :
13642
Rotatable bond count :
2
Rule of five :
0
Hydrogen bond acceptor count :
1
Ionization potential :
9.764617
Hydrogen bond donor count :
0
Electric dipole moment :
3.674
XLogP :
2.1
VDW volume :
156.504238
Molecular weight :
148.088815
HOMO-LUMO gap :
9.303000
Herb list :
Parsley - Petroselinum crispum (Miller) A.W.Hill - جعفری
Refrences & Litretures:
927. Journal:'Journal of Essential Oil Bearing Plant' Year:'2016' Volume:'19' Page:'1993' DOI:'10.1080/0972060X.2016.1256234' Title:'Chemical Composition and Toxicity of the Essential Oil of Coriandrum sativum L. and Petroselinum crispum L. Against Three Stored-Product Insect Pests'
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