(3-Chloro-5-fluorophenyl)(ethyl)sulfane CAS 1314966-90-9
| CAS No. | 1314966-90-9 |
| Molecular Formula | C8H8ClFS |
| Molecular Weight | 190.67 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 190.67 g/mol gives (3-Chloro-5-fluorophenyl)(ethyl)sulfane distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
(3-Chloro-5-fluorophenyl)(ethyl)sulfane (CAS 1314966-90-9), molecular formula C8H8ClFS and molecular weight 190.67 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, (3-Chloro-5-fluorophenyl)(ethyl)sulfane (C8H8ClFS) contains sulfur-containing functionality, fluorine/chlorine substitution, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 4.0, corresponding to approximately 4 ring(s) or double-bond equivalent(s). With a molecular weight of 190.67 g/mol, it falls into the medium-molecular-weight range. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C8H8ClFS |
| Molecular Weight | 190.67 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | May oxidize slowly on prolonged air exposure |
| Degree of Unsaturation (DBE) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F/Cl-containing |
| Sulfur Atoms | 1 |
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