3-((4-(4-(2,4-Diaminopyrimidin-5-yl)butyl)phenyl)carbamoyl)benzene-1-sulfonyl fluoride sulfate CAS 21877-93-0
| CAS No. | 21877-93-0 |
| Molecular Formula | C21H22FN5O3S |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 3-((4-(4-(2,4-Diaminopyrimidin-5-yl)butyl)phenyl)carbamoyl)benzene-1-sulfonyl fluoride sulfate is closely related to a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 3-((4-(4-(2,4-Diaminopyrimidin-5-yl)butyl)phenyl)carbamoyl)benzene-1-sulfonyl fluoride sulfate (CAS 21877-93-0), a certified reference material (molecular formula C21H22FN5O3SH2O4S, MW 541.57 g/mol) for analytical method development and quality control.
3-((4-(4-(2,4-Diaminopyrimidin-5-yl)butyl)phenyl)carbamoyl)benzene-1-sulfonyl fluoride sulfate (C21H22FN5O3SH2O4S) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; 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.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C21H22FN5O3S H2O4S |
| Molecular Weight | 541.57 g/mol |
| 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) | 12.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1963 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 2 |
Related Diaminopyrimidin Standards
- (2,4-Diaminopyrimidin-5-yl)boronic acid (CAS 1045861-29-7)
- 4,5-Diaminopyrimidin-2-ol (CAS 1071046-18-8)
- 1-(4,6-Diaminopyrimidin-5-yl)guanidine (CAS 107930-05-2)
- 1-(2,6-Diaminopyrimidin-4-yl)piperidin-3-ol (CAS 111152-92-2)
- Methyl 3-((4,6-diaminopyrimidin-2-yl)thio)propanoate (CAS 1147332-24-8)
- 2,5-Diaminopyrimidin-4(3H)-one sulfate (CAS 127726-94-7)
- 1,4-Diaminopyrimidin-2(1H)-one (CAS 137062-89-6)
- 2,4-diaminopyrimidin-5-ol dihydrochloride (CAS 141124-58-5)
Recommended Standards
- 5-Iodo-1-(4-methoxybenzyl)-1H-indazole (CAS 753922-50-8)
- 1-Bromo-2-difluoromethoxy-6-fluoro-4-nitrobenzene (CAS 1805524-99-5)
- Ethyl 4-phenyl-1H-imidazole-5-carboxylate (CAS 80304-39-8)
- 2,4-Difluorobenzoyl Chloride (CAS 72482-64-5)
- N'-{1-[5-chloro-1-(2,4-dichlorophenyl)-6-oxo-1,6-dihydropyridazin-4-yl]piperidin-4-ylidene}-1-(6-chloropyridazin-3-yl)piperidine-4-carbohydrazide (CAS 338413-82-4)
- 3-(2-Hydroxyethyl)benzo[d][1,2,3]triazin-4(3H)-one (CAS 72553-67-4)
- 5-ethyl-6-hydroxy-3-(3-methoxyphenyl)-2-sulfanyl-3,4-dihydropyrimidin-4-one (CAS 1235440-68-2)
- (R)-2-((tert-Butoxycarbonyl)amino)-4-(naphthalen-1-yl)butanoic acid (CAS 188647-18-9)
- 2′-Cyano-N,N-dimethyl[1,1′-biphenyl]-4-carboxamide (CAS 1365272-24-7)
- Renin Inhibitor Peptide (CAS 50410-01-0)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com