| CAS No. | 731827-03-5 |
| Molecular Formula | C16H20ClN3S |
| Molecular Weight | 321.87 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Compared with other compounds in its class, the molecular weight of 321.87 g/mol gives 4-Chloro-5,6,7,8-tetrahydro-2-(1-piperidinylmethyl)[1]benzothieno[2,3-d]pyrimidine distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
4-Chloro-5,6,7,8-tetrahydro-2-(1-piperidinylmethyl)[1]benzothieno[2,3-d]pyrimidine (CAS 731827-03-5), molecular formula C16H20ClN3S and molecular weight 321.87 g/mol, is a CATO reference standard with documented purity and traceability.
4-Chloro-5,6,7,8-tetrahydro-2-(1-piperidinylmethyl)[1]benzothieno[2,3-d]pyrimidine (C16H20ClN3S) contains a nitrogen-containing heterocyclic scaffold, a nitrile group, sulfur-containing functionality, chlorine 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.
| Molecular Formula | C16H20ClN3S |
| Molecular Weight | 321.87 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light |
| 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1986 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |