Chemical Compound

Tofacitinib citrate

CAS Registry Number 540737-29-9
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Tofacitinib citrate chemical structure
Primary Record

Tofacitinib citrate

In stock
8,347 g
Purity
98.4 %
CAS
540737-29-9

Compound Identifiers & Properties

CAS
540737-29-9
PubChem CID
92045623
SMILES
C[C@@H]1CCN(C[C@H]1N(C)C2=NC=NC3=C2C=CN3)C(=O)CC#N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
Canonical SMILES
C[C@@H]1CCN(C(=O)CC#N)C[C@H]1N(C)c1ncnc2[nH]ccc12.O=C(O)CC(O)(CC(=O)O)C(=O)O

Names & Synonyms

  • Tofacitinib citrate
  • A10241
  • 540737-29-9