Upadacitinib Hydrate
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About Upadacitinib Hydrate
Upadacitinib Hydrate belongs to the Upadacitinib reference-standard family in the Zemixal catalogue. For your records (Reference Standard), the material is defined by CAS 2050057-56-0, formula C34H40F6N12O3 and molar mass 778.8 g/mol. It is handled as a solid.
Typical applications
- Identification & assay
- Method development & validation
- QC reference material
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See every impurity, metabolite and related compound we list for this API.
Upadacitinib standardsTypical uses
- Identification & assay
- Method development & validation
- QC reference material
Applications
Specifications and identifiers
| Product name | Upadacitinib Hydrate |
|---|---|
| Catalogue number | ZX-006888 |
| CAS number | 2050057-56-0 |
| IUPAC name | bis((3S,4R)-3-ethyl-4-(1,5,7,10-tetrazatricyclo[7.3.0.02,6]dodeca-2(6),3,7,9,11-pentaen-12-yl)-N-(2,2,2-trifluoroethyl)pyrrolidine-1-carboxamide);hydrate |
| Molecular formula | C34H40F6N12O3 |
| Molar mass | 778.8 g/mol |
| Exact mass | 778.3251 |
| Grade | Reference Standard |
| Physical form | Solid |
| H-bond donors / acceptors | 5 / 13 |
| Topological polar surface area | 158 Ų |
| HS code | 38229090 |
| InChIKey | GJMQTRCDSIQEFK-SCDRJROZSA-N |
| SMILES | CC[C@@H]1CN(C[C@@H]1C2=CN=C3N2C4=C(NC=C4)N=C3)C(=O)NCC(F)(F)F.CC[C@@H]1CN(C[C@@H]1C2=CN=C3N2C4=C(NC=C4)N=C3)C(=O)NCC(F)(F)F.O |
| PubChem CID | 133053456 |
| Synonyms | Upadacitinib hemihydrate, Upadacitinib hydrate (JAN), Rinvoq (TN), Upadacitinib (as hemihydrate) |
Lot values are stated on the batch certificate of analysis. Ask for a typical COA with your quotation.
Safety and GHS hazards
No GHS classification is on file for this item. Handle it as an unknown laboratory chemical and request the SDS with your quotation.
Pack sizes
| 10 mg | Quoted on request | |
| 25 mg | Quoted on request | |
| 50 mg | Quoted on request | |
| 100 mg | Quoted on request |
Need a different size? Bulk drums and custom packing are quoted on request through the quote form on this page.
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More Upadacitinib standards
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- CAS
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- MW
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