3,7-Dihydro-3-methyl-7-propyl-1H-purine-2,6-dione

CAS Registry Number®

55242-64-3
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CAS Name

3,7-Dihydro-3-methyl-7-propyl-1H-purine-2,6-dione

Molecular Formula

C9H12N4O2

Molecular Mass

208.22

Cite this Page

3,7-Dihydro-3-methyl-7-propyl-1H-purine-2,6-dione.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=55242-64-3 (retrieved 2024-04-29) (CAS RN: 55242-64-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    250-252 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C9H12N4O2/c1-3-4-13-5-10-7-6(13)8(14)11-9(15)12(7)2/h5H,3-4H2,1-2H3,(H,11,14,15)

InChIKey

InChIKey=MHNVSFOURBQRPK-UHFFFAOYSA-N

SMILES

C(CC)N1C2=C(N(C)C(=O)NC2=O)N=C1

Canonical SMILES

O=C1NC(=O)N(C=2N=CN(C12)CCC)C

Other Names for this Substance

  • 1H-Purine-2,6-dione, 3,7-dihydro-3-methyl-7-propyl-
  • 3,7-Dihydro-3-methyl-7-propyl-1H-purine-2,6-dione
  • 3-Methyl-7-propylxanthine
  • 3-Methyl-7-n-propylxanthine
  • 3-Methyl-7-propylpurine-2,6-dione

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