Chemical Compound

Theophylline monohydrate

CAS Registry Number 5967-84-0
Theophylline monohydrate chemical structure
Primary Record

Theophylline monohydrate

In stock
3,265 g
Purity
99.6 %
CAS
5967-84-0

Compound Identifiers & Properties

CAS
5967-84-0
PubChem CID
71650720
SMILES
CN1C(=O)C2=NC=NC2=[N+](C1=O)C.O
Canonical SMILES
CN1C(=O)C2=NC=NC2=[N+](C)C1=O.O

Names & Synonyms

  • Theophylline monohydrate
  • Theophylline hydrate
  • 1,3-Dimethylxanthine monohydrate
  • 1,3-dimethyl-7H-purine-2,6-dione hydrate
  • RT-004161
  • 5967-84-0
  • 1H-Purine-2,6-dione, 3,7-dihydro-1,3-dimethyl-, compd. with1,2-ethanediamine (2:1)OTHER CA INDEX NAMES:1,2-Ethanediamine, compd. with3,7-dihydro-1,3-dimethyl-1H-purine-2,6-dione (1:2)
  • 317-34-0