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ScientificNameLabel
3,5-dimethyl-2-isobutylpyrazine
PHCD compound ID : 2178
Chemical Names :
3,5-dimethyl-2-isobutylpyrazine
Molecular Formula : C10H16N2
Molecular Weight : 164.131349
More Details :
Names & Synonyms: 2-isobutyl-3,5-dimethyl-pyrazine , 3,5-dimethyl-2-(2-methylpropyl)pyrazine
Smiles: CC(Cc1ncc(nc1C)C)C
InChi : InChI=1S/C10H16N2/c1-7(2)5-10-9(4)12-8(3)6-11-10/h6-7H,5H2,1-4H3
InChi Key : InChIKey=PBBZXNLEMPGGCH-UHFFFAOYSA-N
PubChem ID : 578817
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 2 Ionization potential : 9.495660
Hydrogen bond donor count : 0 Electric dipole moment : 0.676
XLogP : 1.344 VDW volume : 172.343991
Molecular weight : 164.131349 HOMO-LUMO gap : 9.226000
Herb list :
Refrences & Litretures:
  
257.      Journal:'J. Agric. Food Chem'      Year:'2012'      Volume:'60'      Page:'9097'      DOI:'10.1021/jf301800x'      Title:'Antioxidant Activities of Extracts from Teas Prepared from Medicinal Plants, Morus alba L., Camellia sinensis L., and Cudrania tricuspidata, and Their Volatile Components'
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