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4-Pyrimidinamine.2.6-dimethyl-
PHCD compound ID : 3708
Chemical Names :
4-Pyrimidinamine.2.6-dimethyl-
Molecular Formula : C6H9N3
Molecular Weight : 123.079647
More Details :
Names & Synonyms: 2,6-dimethylpyrimidin-4-amine , 2,6-dimethyl-4-pyrimidinamine , (2,6-dimethylpyrimidin-4-yl)amine
Smiles: Cc1cc(N)nc(n1)C
InChi : InChI=1S/C6H9N3/c1-4-3-6(7)9-5(2)8-4/h3H,1-2H3,(H2,7,8,9)
InChi Key : InChIKey=BJJDXAFKCKSLTE-UHFFFAOYSA-N
PubChem ID : 68039
Rotatable bond count : 0 Rule of five : 0
Hydrogen bond acceptor count : 3 Ionization potential : 9.270402
Hydrogen bond donor count : 1 Electric dipole moment : 2.846
XLogP : -0.29 VDW volume : 114.156812
Molecular weight : 123.079647 HOMO-LUMO gap : 9.275000
Herb list :
Refrences & Litretures:
  
513.      Journal:'J. of Supercritical Fluids'      Year:'2014'      Volume:'95'      Page:'373'      DOI:'10.1016/j.sup?u.2014.08.009'      Title:'Bio-oil production from Glycyrrhiza glabra through supercritical ?uid extraction'
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