4-(5-Fluoro-1h-1,3-benzodiazol-2-yl)aniline CAS 872552-44-8
| CAS No. | 872552-44-8 |
| Molecular Formula | C13H10FN3 |
| Molecular Weight | 227.24 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 227.24 g/mol gives 4-(5-Fluoro-1h-1,3-benzodiazol-2-yl)aniline distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
4-(5-Fluoro-1h-1,3-benzodiazol-2-yl)aniline (CAS 872552-44-8) is a high-purity analytical reference standard with the molecular formula C13H10FN3 and a molecular weight of 227.24 g/mol.
4-(5-Fluoro-1h-1,3-benzodiazol-2-yl)aniline (C13H10FN3) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, fluorine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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 | C13H10FN3 |
| Molecular Weight | 227.24 g/mol |
| 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) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
Related Fluoro Standards
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