| CAS No. | 1393887-94-9 |
| Molecular Formula | C22H20ClFN4O |
| Molecular Weight | 410.87 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
This reference standard is suitable for quantitative analysis on major chromatographic platforms including HPLC, GC, LC-MS/MS, and GC-MS, serving as an external calibration standard or a system suitability test reference material.
CATO supplies 6-(5-(4-Aminobutyl)-3-chloro-2-fluorophenyl)-3-phenyl-3,7-dihydro-2H-pyrrolo[2,3-d]pyrimidin-2-one (CAS 1393887-94-9), a certified reference material (molecular formula C22H20ClFN4O, MW 410.87 g/mol) for analytical method development and quality control.
The molecular framework of 6-(5-(4-Aminobutyl)-3-chloro-2-fluorophenyl)-3-phenyl-3,7-dihydro-2H-pyrrolo[2,3-d]pyrimidin-2-one (C22H20ClFN4O) is characterized by a steroid core, an amide group, a hydroxyl group, an ether linkage, fluorine/chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
CATO manufactures 6-(5-(4-Aminobutyl)-3-chloro-2-fluorophenyl)-3-phenyl-3,7-dihydro-2H-pyrrolo[2,3-d]pyrimidin-2-one 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.
| Molecular Formula | C22H20ClFN4O |
| Molecular Weight | 410.87 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| 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.) | 1991 |
| Halogen Content | F/Cl-containing |
| Nitrogen Atoms | 4 |