3,9-Dihydro-9-methyl-1H-purine-2,6-dione

CAS Registry Number®

1198-33-0

CAS Name

3,9-Dihydro-9-methyl-1H-purine-2,6-dione

Molecular Formula

C6H6N4O2

Molecular Mass

166.14

Cite this Page

3,9-Dihydro-9-methyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1198-33-0 (retrieved 2024-11-22) (CAS RN: 1198-33-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H6N4O2/c1-10-2-7-3-4(10)8-6(12)9-5(3)11/h2H,1H3,(H2,8,9,11,12)

InChIKey

InChIKey=DHNIKYWYTSMDDA-UHFFFAOYSA-N

SMILES

O=C1C2=C(NC(=O)N1)N(C)C=N2

Canonical SMILES

O=C1NC(=O)C=2N=CN(C2N1)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,9-dihydro-9-methyl-
  • Xanthine, 9-methyl-
  • 3,9-Dihydro-9-methyl-1H-purine-2,6-dione
  • 9-Methylxanthine
  • NSC 4917

Deleted or Replaced CAS Registry Numbers

42484-36-6

CAS INSIGHTSTM
Targeted protein degrader structure, illustration