9-Benzyl-2-chloro-N-(3-(methylsulfonyl)phenyl)-9H-purin-6-amine CAS 125802-65-5
| CAS No. | 125802-65-5 |
| Molecular Formula | C19H16ClN5O2S |
| Molecular Weight | 413.88 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of 9-Benzyl-2-chloro-N-(3-(methylsulfonyl)phenyl)-9H-purin-6-amine (C19H16ClN5O2S) is characterized by a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, 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. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
9-Benzyl-2-chloro-N-(3-(methylsulfonyl)phenyl)-9H-purin-6-amine (CAS 125802-65-5) is a high-purity analytical reference standard with the molecular formula C19H16ClN5O2S and a molecular weight of 413.88 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.
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 | C19H16ClN5O2S |
| Molecular Weight | 413.88 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) | 14.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1992 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 5 |
| Sulfur Atoms | 1 |
Related Benzyl Standards
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Recommended Standards
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- Ethyl 2-(2-((5-(3-chloropyridin-2-yl)-1H-indazol-3-yl)amino)thiazol-5-yl)acetate (CAS 1093968-01-4)
- 2-Amino-6-(5-chloro-1-(4-methoxyphenyl)-6-oxo-1,6-dihydropyridazin-4-yl)-4,5,6,7-tetrahydrothieno[2,3-c]pyridine-3-carbonitrile (CAS 338413-85-7)
- N-(2-(2-(2-(4-Chlorophenyl)acetyl)hydrazine-1-carbonyl)phenyl)thiophene-2-carboxamide (CAS 1090837-09-4)
- N-(4-Ethylbenzo[d]thiazol-2-yl)-3-phenoxypropanamide (CAS 892858-19-4)
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- 3-((2-Chloropyridin-4-yl)methyl)-1-cyclobutyl-3,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-c]isoquinolin-5-one (CAS 1951439-42-1)
- (R)-2-(4-methoxyphenyl)-2-(methylamino)ethan-1-ol (CAS 1336079-07-2)
- 2-((1H-1,2,4-triazol-5-yl)thio)-1-(4-chlorophenyl)ethan-1-one (CAS 37664-31-6)
- n-(4-Amino-2-chlorophenyl)-3-methanesulfonylbenzamide (CAS 926208-38-0)
- N-(3-Chloro-4-fluorophenyl)-4-hydroxy-1-methyl-1H-thieno[3,2-c][1,2]thiazine-3-carbothioamide 2,2-dioxide (CAS 320423-78-7)
- Ac, Gastrin Releasing Peptide (20-27), porcine (CAS 77714-20-6)
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