5-(6-(Benzyloxy)-3-bromo-2-fluorophenyl)-1,2,5-thiadiazolidin-3-one 1,1-dioxide CAS 1227747-14-9
| CAS No. | 1227747-14-9 |
| Molecular Formula | C15H12BrFN2O4S |
| Molecular Weight | 415.23 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, 5-(6-(Benzyloxy)-3-bromo-2-fluorophenyl)-1,2,5-thiadiazolidin-3-one 1,1-dioxide (C15H12BrFN2O4S) contains a flavonoid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine/bromine substitution. The molecule exhibits a degree of unsaturation (DBE) of 10.0, corresponding to approximately 10 ring(s) or double-bond equivalent(s). With a molecular weight of 415.23 g/mol, it falls into the moderately-high-molecular-weight range. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
5-(6-(Benzyloxy)-3-bromo-2-fluorophenyl)-1,2,5-thiadiazolidin-3-one 1,1-dioxide (CAS 1227747-14-9) is a high-purity analytical reference standard with the molecular formula C15H12BrFN2O4S and a molecular weight of 415.23 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.
As a certified reference material (CRM), 5-(6-(Benzyloxy)-3-bromo-2-fluorophenyl)-1,2,5-thiadiazolidin-3-one 1,1-dioxide meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C15H12BrFN2O4S |
| Molecular Weight | 415.23 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) | 10.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 2 |
| Sulfur Atoms | 1 |
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Recommended Standards
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- Methyl 2-(chloromethyl)-6-methoxybenzoate (CAS 91127-30-9)
- Ethyl 3-((4-chloro-1h-pyrazol-1-yl)methyl)-1,2,4-oxadiazole-5-carboxylate (CAS 1170802-11-5)
- 3-Bromo-7-methoxy-5,6-dimethylpyrazolo-[1,5-a]pyrimidine (CAS 1429309-31-8)
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- Demethylcephalotaxinone (CAS 51020-45-2)
- ((2R,3R,4s,5S)-4-aminocuban-1-yl)methanol hydrochloride (CAS 2108611-48-7)
- Protein Kinase C? Peptide Substrate (CAS 120253-69-2)
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