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ScientificNameLabel
2-Amino-6-chloro-4-(2-ethenylamino) pyrimidine
PHCD compound ID : 1916
Chemical Names :
2-Amino-6-chloro-4-(2-ethenylamino) pyrimidine
Molecular Formula : C6H7Cl1N4
Molecular Weight : 170.035924
More Details :
Names & Synonyms:
Smiles: C=CNc1cc(Cl)nc(n1)N
InChi : InChI=1S/C6H7ClN4/c1-2-9-5-3-4(7)10-6(8)11-5/h2-3H,1H2,(H3,8,9,10,11)
InChi Key : InChIKey=SASOJAFLBBSQRK-UHFFFAOYSA-N
PubChem ID :
Rotatable bond count : 2 Rule of five : 0
Hydrogen bond acceptor count : 4 Ionization potential : 9.110960
Hydrogen bond donor count : 2 Electric dipole moment : 2.875
XLogP : 0.138 VDW volume : 137.728182
Molecular weight : 170.035924 HOMO-LUMO gap : 8.639000
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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