6-Chloro-9-(tetrahydrofuran-2-yl)-9H-purine CAS 91366-99-3
| CAS No. | 91366-99-3 |
| Molecular Formula | C9H9ClN4O |
| Molecular Weight | 224.65 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
6-Chloro-9-(tetrahydrofuran-2-yl)-9H-purine (CAS 91366-99-3) is a high-purity analytical reference standard with the molecular formula C9H9ClN4O and a molecular weight of 224.65 g/mol.
Based on its molecular formula C9H9ClN4O, 6-Chloro-9-(tetrahydrofuran-2-yl)-9H-purine contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 224.65 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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.
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 | C9H9ClN4O |
| Molecular Weight | 224.65 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor, faint amine-like odor) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1983 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |
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Recommended Standards
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- 2-Methyl-9-phenoxyacridine (CAS 61078-24-8)
- (S)-2-Amino-N-(3-chloro-benzyl)-N-ethyl-3-methyl-butyramide (CAS 1354001-29-8)
- 2-Cyclohexyl-2-methoxypropan-1-amine (CAS 1491355-97-5)
- 1-((1R,2R)-2-Aminocyclohexyl)-3-(3,5-bis(trifluoromethyl)phenyl)urea (CAS 705928-69-4)
- Peptide Impurity 13 (CAS CATO-CPTD788813)
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