Chemical Compound

8(p-sulfophenyl)theophylline

CAS Registry Number 80206-91-3
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8(p-sulfophenyl)theophylline chemical structure
Primary Record

8(p-sulfophenyl)theophylline

In stock
6,245 g
Purity
98.8 %
CAS
80206-91-3

Compound Identifiers & Properties

CAS
80206-91-3
PubChem CID
73449114
SMILES
CN1C(=O)C2=NC(=NC2=[N+](C1=O)C)C3=CC=C(C=C3)S(=O)(=O)O
Canonical SMILES
CN1C(=O)C2=NC(c3ccc(S(=O)(=O)O)cc3)=NC2=[N+](C)C1=O

Names & Synonyms

  • 8(p-sulfophenyl)theophylline
  • CHEMBL8488
  • TR-061147
  • 4-(1,3-dimethyl-2,6-dioxo-2,3,6,9-tetrahydro-1H-purin-8-yl)benzenesulfonic acid
  • 80206-91-3