Tofacitinib Impurity 62 Citrate

cas: 2174011-55-1 — see every product listed under this CAS number, including other names

Tofacitinib Impurity 62 Citrate (CAS 2174011-55-1) is a chemical reagent available from Chemat. Available pack sizes: on request. Offered by: Chemat Brand.

brandChemat Brand
catalog numberULT117005
cas2174011-55-1
sizeon request
availability Do potwierdzenia przez Chemat|To be confirmed by Chemat
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categoryChemicals
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2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile (CAS 2174011-55-1) is a chemical compound with the molecular formula C22H28N6O8 and a molecular weight of 504.5 g/mol. IUPAC name: 2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile. InChIKey: SYIKUFDOYJFGBQ-STEACBGWSA-N.

Identity
Molecular formulaC22H28N6O8
Molecular weight504.5 g/mol
IUPAC name2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3S,4S)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile
InChIKeySYIKUFDOYJFGBQ-STEACBGWSA-N
SMILESC[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

Computed by PubChem (NCBI)

Synonyms: (3S,4S)-Tofacitinib Citrate
Related forms of this compound
2-hydroxypropane-1,2,3-tricarboxylic acid;3-[(3R,4R)-4-methyl-3-[methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile C22H28N6O8

Also listed as

3-((3S,4S)-4-Methyl-3-(methyl(7H-pyrrolo[2,3-d]pyrimidin-4-yl)amino)piperidin-1-yl)-3-oxopropanenitrile 2-hydroxypropane-1,2,3-tricarboxylate, 99+% Chemat Brand CAS 2174011-55-1