Ethyl 2-[2,4-dichloro-5-(3,5-dioxo-1,4-thiazinan-4-yl)phenoxy]acetate CAS 339015-01-9
| CAS No. | 339015-01-9 |
| Molecular Formula | C14H13Cl2NO5S |
| Molecular Weight | 378.23 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Structurally, Ethyl 2-[2,4-dichloro-5-(3,5-dioxo-1,4-thiazinan-4-yl)phenoxy]acetate (C14H13Cl2NO5S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, chlorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 8.0, corresponding to approximately 8 ring(s) or double-bond equivalent(s). With a molecular weight of 378.23 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.
Ethyl 2-[2,4-dichloro-5-(3,5-dioxo-1,4-thiazinan-4-yl)phenoxy]acetate (CAS 339015-01-9) is a high-purity analytical reference standard with the molecular formula C14H13Cl2NO5S and a molecular weight of 378.23 g/mol.
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 | C14H13Cl2NO5S |
| Molecular Weight | 378.23 g/mol |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep sealed and dry |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO, water (slightly soluble) |
| 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
Related Ethyl Standards
- 1-[2,4-Dichloro-5-(2-methoxyethoxy)phenyl]-4-phenyl-1H-pyrazol-5-amine (CAS 400085-57-6)
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Recommended Standards
- 7-{[(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl]oxy}-2H-1-benzopyran-2-one CBBE (CAS 1522117-80-1)
- Methyl 3-((tert-butoxycarbonyl)amino)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)picolinate (CAS 2377606-60-3)
- 2-((4-Chlorophenyl)sulfonyl)-2-(3-chloroquinoxalin-2-yl)acetonitrile (CAS 121512-60-5)
- tert-Butyl (4-nitro-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzyl)carbamate (CAS 2377609-03-3)
- N-(2,4-Difluorophenyl)-2-((4-ethyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide (CAS 573931-40-5)
- 3-(6-Bromo-1H-indol-1-yl)propan-1-amine (CAS 1158510-24-7)
- N-(4-{[2-(trifluoromethyl)quinazolin-4-yl]oxy}phenyl)acetamide (CAS 341964-16-7)
- 4-Phenethyl-oxazolidin-2-one (CAS 1276027-20-3)
- Methyl 5-Methoxy-6-nitropyridine-2-carboxylate (CAS 390816-44-1)
- N-(4-Amino-2-methylphenyl)-2-(2-methoxyphenoxy)-acetamide (CAS 954267-86-8)
- (S)-1-(3-(Methylamino)pyrrolidin-1-yl)ethanone (CAS 1354009-37-2)
- 1H-Pyrazolo[3,4-d]pyrimidine-3-carbonitrile, 4-chloro-6-(methylthio)- (CAS 1379363-08-2)
- (4-(((tert-Butyldiphenylsilyl)oxy)methyl)phenyl)methanol (CAS 146952-73-0)
- MOTS-c Peptide (CAS 1627580-64-6)
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