((3aR,6aS)-5-(4,6-dimethylpyrimidin-2-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)(2-fluoro-6-(2H-1,2,3-triazol-2-yl)phenyl)methanone CAS 1452539-75-1
| CAS No. | 1452539-75-1 |
| Molecular Formula | C21H22FN7O |
| Molecular Weight | 407.44 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
((3aR,6aS)-5-(4,6-dimethylpyrimidin-2-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)(2-fluoro-6-(2H-1,2,3-triazol-2-yl)phenyl)methanone (C21H22FN7O) contains a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. Halogen substitution raises its density and boiling point; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
((3aR,6aS)-5-(4,6-dimethylpyrimidin-2-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)(2-fluoro-6-(2H-1,2,3-triazol-2-yl)phenyl)methanone (CAS 1452539-75-1) is a high-purity analytical reference standard with the molecular formula C21H22FN7O and a molecular weight of 407.44 g/mol.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures ((3aR,6aS)-5-(4,6-dimethylpyrimidin-2-yl)hexahydropyrrolo[3,4-c]pyrrol-2(1H)-yl)(2-fluoro-6-(2H-1,2,3-triazol-2-yl)phenyl)methanone under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C21H22FN7O |
| Molecular Weight | 407.44 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor) |
| Purity | 97%+ |
| Storage | Store at room temperature, protect from light |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1992 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 7 |
Recommended Standards
- N-(4-methoxyphenyl)-1-(phenylsulfonyl)-1H-pyrrolo[2,3-b]pyridine-2-carboxamide (CAS 477872-22-3)
- Linezolid Impurity 27 (CAS CATO-C4X-107327)
- Methyl 3-(4-((3-fluorophenyl)sulfonamido)phenoxy)thiophene-2-carboxylate (CAS 900015-22-7)
- Cefprozil Impurity 52 (CAS CATO-C4X-149252)
- tert-Butyl 4-(3-fluoro-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)piperazine-1-carboxylate (CAS 1129541-83-8)
- 5,6-Dimethyl-3-(pyrrolidin-1-yl)pyridazine-4-carboxamide (CAS 1311314-09-6)
- 8-(2-Aminoethyl)-1-phenyl-1,3,8-triazaspiro[4.5]Decan-4-one (CAS 1130067-45-6)
- N-Butyl-N-(5-phenyl-1H-1,2,4-triazol-3-yl)butyramide (CAS 62400-14-0)
- 1-tert-Butyl -5-(trifluoromethyl)-1H-imidazole (CAS 234450-32-9)
- 7-methoxy-3,4-dihydro-2H-1-benzopyran-4-carboxylic acid (CAS 80858-98-6)
- Vericiguat Impurity 98 (CAS 907165-30-4)
- Rupintrivir (CAS 223537-30-2)
- 2,5-Dimethyl[1,2,4]triazolo[1,5-a]pyrimidin-7(4H)-one (CAS 89852-99-3)
- D-Ala28-Tirzepatide (CAS CATO-CPTD788906)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
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- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com