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3,7-dimethyl-1,3,6,7-tetrahydro-2H-purin-2-one

Base Information Edit
  • Chemical Name:3,7-dimethyl-1,3,6,7-tetrahydro-2H-purin-2-one
  • CAS No.:98335-22-9
  • Molecular Formula:C7H10N4O
  • Molecular Weight:166.183
  • Hs Code.:
  • NSC Number:28369
  • DSSTox Substance ID:DTXSID001034583
  • Mol file:98335-22-9.mol
3,7-dimethyl-1,3,6,7-tetrahydro-2H-purin-2-one

Synonyms:NSC28369;3,7-dimethyl-1,3,6,7-tetrahydro-2H-purin-2-one;DTXSID001034583;NSC-28369;98335-22-9

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Chemical Property of 3,7-dimethyl-1,3,6,7-tetrahydro-2H-purin-2-one Edit
Chemical Property:
  • XLogP3:-0.9
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:2
  • Rotatable Bond Count:0
  • Exact Mass:166.08546096
  • Heavy Atom Count:12
  • Complexity:208
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  • Canonical SMILES:CN1C=NC2=C1CNC(=O)N2C
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