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4,6-Diethyl-2-methoxypyrimidine
PHCD compound ID : 1912
Chemical Names :
4,6-Diethyl-2-methoxypyrimidine
Molecular Formula : C9H14N2O1
Molecular Weight : 166.110613
More Details :
Names & Synonyms: 4,6-diethyl-2-methoxy-pyrimidine , 4,6-diethyl-2-methoxypyrimidine
Smiles: CCc1cc(CC)nc(n1)OC
InChi : InChI=1S/C9H14N2O/c1-4-7-6-8(5-2)11-9(10-7)12-3/h6H,4-5H2,1-3H3
InChi Key : InChIKey=CVCORHUMZKSEAO-UHFFFAOYSA-N
PubChem ID : 12343179
Rotatable bond count : 3 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.660279
Hydrogen bond donor count : 0 Electric dipole moment : 2.792
XLogP : 0.737 VDW volume : 163.838233
Molecular weight : 166.110613 HOMO-LUMO gap : 9.565000
Herb list :
Refrences & Litretures:
  
224.      Journal:'Industrial Crops and Products'      Year:'2012'      Volume:'36'      Page:'81'      DOI:'10.1016/j.indcrop.2011.08.011'      Title:'European pennyroyal (Mentha pulegium) from Portugal: Chemical composition of essential oil and antioxidant and antimicrobial properties of extracts and essential oil'
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