(1S,2R,4S,5R)-1-(2-((2-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide CAS 2798945-97-6
| CAS No. | 2798945-97-6 |
| Molecular Formula | C31H38N3O2 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
(1S,2R,4S,5R)-1-(2-((2-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide (CAS 2798945-97-6), molecular formula C31H38N3O2Br and molecular weight 564.57 g/mol, is a CATO reference standard with documented purity and traceability.
The molecular framework of (1S,2R,4S,5R)-1-(2-((2-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide (C31H38N3O2Br) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine 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. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
CATO manufactures (1S,2R,4S,5R)-1-(2-((2-(tert-Butyl)phenyl)amino)-2-oxoethyl)-2-((S)-hydroxy(quinolin-4-yl)methyl)-5-vinylquinuclidin-1-ium bromide 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 | C31H38N3O2 Br |
| Molecular Weight | 564.57 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor) |
| Purity | 97%+ |
| Storage | Store in a cool place (≤25°C), protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in DMSO, DMF, methanol |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light; Hygroscopic; reseal immediately after opening; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2003 |
| Halogen Content | Br-containing |
| Nitrogen Atoms | 3 |
Recommended Standards
- 6,7-Dimethylquinolin-4-ol (CAS 185437-33-6)
- 4-{[4-(4-tert-butylbenzoyloxy)phenyl]sulfanyl}phenyl 4-tert-butylbenzoate (CAS 331460-28-7)
- 2-(Furan-3-yl)benzoic acid (CAS 1340107-48-3)
- 7,8-Dimethylquinolin-4-amine (CAS 948293-29-6)
- tert-Butyl 4-(3-amino-6-((1S,3S,4S)-4-((tert-butyldimethylsilyl)oxy)-3-fluorocyclohexyl)pyrazin-2-yl)-2-fluorobenzoate (CAS 1715032-87-3)
- 2-Butyryl-3,5-dihydroxycyclohex-2-en-1-one (CAS 154037-62-4)
- 5-[(2R)-pyrrolidin-2-yl]-2H-1,2,3,4-tetrazole (CAS 702700-79-6)
- 5-Bromo-N-[3-(dimethylamino)propyl]pyridin-2-amine (CAS 1039987-25-1)
- N-(1,3-Diphenyl-1H-pyrazol-5-yl)-4-fluorobenzamide (CAS 781652-51-5)
- Semaglutide Impurity 185 (CAS CATO-C4X-2226185)
Why CATO?
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