1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetamide

CAS Registry Number®

5614-55-1

CAS Name

1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetamide

Molecular Formula

C9H11N5O3

Molecular Mass

237.22

Cite this Page

1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetamide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=5614-55-1 (retrieved 2024-11-22) (CAS RN: 5614-55-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    275 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H11N5O3/c1-12-7-6(8(16)13(2)9(12)17)14(4-11-7)3-5(10)15/h4H,3H2,1-2H3,(H2,10,15)

InChIKey

InChIKey=QPSKKCDYWZWBCM-UHFFFAOYSA-N

SMILES

C(C(N)=O)N1C2=C(N(C)C(=O)N(C)C2=O)N=C1

Canonical SMILES

O=C1C2=C(N=CN2CC(=O)N)N(C(=O)N1C)C

Other Names for this Substance

  • 7H-Purine-7-acetamide, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-
  • Purine-7-acetamide, 1,2,3,6-tetrahydro-1,3-dimethyl-2,6-dioxo-
  • 1,2,3,6-Tetrahydro-1,3-dimethyl-2,6-dioxo-7H-purine-7-acetamide
  • 7-Theophyllineacetamide
  • 2-(1,3-Dimethyl-2,6-dioxopurin-7-yl)acetamide

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