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2,2,3,4-tetramethyl-3-cyclopenten-1-one
PHCD compound ID : 5205
Chemical Names :
2,2,3,4-tetramethyl-3-cyclopenten-1-one
Molecular Formula : C9H14O1
Molecular Weight : 138.104465
More Details :
Names & Synonyms: 2,2,3,4-tetramethylcyclopent-3-en-1-one , 2,2,3,4-tetramethyl-1-cyclopent-3-enone
Smiles: CC1=C(C)C(C(=O)C1)(C)C
InChi : InChI=1S/C9H14O/c1-6-5-8(10)9(3,4)7(6)2/h5H2,1-4H3
InChi Key : InChIKey=FKOBKLAYZLQASW-UHFFFAOYSA-N
PubChem ID : 565691
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 1 Ionization potential : 9.334155
Hydrogen bond donor count : 0 Electric dipole moment : 3.181
XLogP : 1.261 VDW volume : 155.381171
Molecular weight : 138.104465 HOMO-LUMO gap : 10.253000
Herb list :
Refrences & Litretures:
  
823.      Journal:'Asian J Pharm Clin Res'      Year:'2019'      Volume:'12'      Page:'124'      DOI:'10.22159/ajpcr.2019.v12i1.28418'      Title:'BIOACTIVITIES AND CHEMOPROFILING COMPARISONS OF CHENOPODIUM AMBROSIOIDES L. AND CHENOPODIUM BOTRYS L. GROWING IN KASHMIR, INDIA'
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