ChemSpider 2D Image | Theophylline monohydrate | C7H10N4O3

Theophylline monohydrate

  • Molecular FormulaC7H10N4O3
  • Average mass198.179 Da
  • Monoisotopic mass198.075287 Da
  • ChemSpider ID82416

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

Theophylline monohydrate
1,3-dimethyl-2,3,6,7-tetrahydro-1H-purine-2,6-dione hydrate
1,3-dimethyl-2,3,6,9-tetrahydro-1H-purine-2,6-dione hydrate
1,3-Dimethyl-3,7-dihydro-1H-purin-2,6-dionhydrat (1:1) [German] [ACD/IUPAC Name]
1,3-Dimethyl-3,7-dihydro-1H-purine-2,6-dione hydrate (1:1) [ACD/IUPAC Name]
1,3-Diméthyl-3,7-dihydro-1H-purine-2,6-dione, hydrate (1:1) [French] [ACD/IUPAC Name]
1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, hydrate (1:1) [ACD/Index Name]
1H-Purine-2,6-dione, 3,9-dihydro-1,3-dimethyl-, hydrate (1:1)
3,7-Dihydro-1,3-dimethyl-1H-purine-2,6-dione Monohydrate
5967-84-0 [RN]
More...

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

NCGC00017052-01 [DBID]
Prestwick_1055 [DBID]
  • Experimental Physico-chemical Properties
  • Miscellaneous

    • Safety:

      22 Alfa Aesar A15997
      36 Alfa Aesar A15997
      6.1 Alfa Aesar A15997
      Danger Alfa Aesar A15997
      DANGER: POISON, irritates skin, eyes, lungs Alfa Aesar A15997
      H301 Alfa Aesar A15997
      P264-P270-P301+P310-P321-P405-P501a Alfa Aesar A15997
      WARNING: Irreversible damage risk, protect skin/eyes/lungs. Alfa Aesar A15997

    • Target Organs:

      Adenosine Receptor antagonist;HDAC2 activator;PDE inhibitor TargetMol T1083L

    • Bio Activity:

      Adenosine receptor;HDAC2;PDE TargetMol T1083L
      Chromatin/Epigenetic; GPCR/G Protein; Metabolism TargetMol T1083L

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

No predicted properties have been calculated for this compound.

Click to predict properties on the Chemicalize site


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