Resmetirom impurity 114 CAS CATO-C4X-2912114
| CAS No. | CATO-C4X-2912114 |
| Molecular Formula | C14H12Cl2N4O5 |
| Molecular Weight | 387.17 g/mol |
| Category | Pharmacopoeial Impurity Standards / EP Impurities |
| Availability | In Stock |
Chemical Structure
Description
The molecular framework of Resmetirom impurity 114 (C14H12Cl2N4O5) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine substitution. In reversed-phase chromatography, its retention is governed primarily by the protonation state of its nitrogen-containing groups, which provides a practical basis for HPLC-UV/DAD or LC-MS method development. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
CATO supplies Resmetirom impurity 114 (CAS CATO-C4X-2912114), a pharmacopoeial impurity reference standard (molecular formula C14H12Cl2N4O5, MW 387.17 g/mol) used for the identification and quantification of trace impurities in APIs.
Recommended for quantitative analysis by HPLC, GC, LC-MS/MS, or GC-MS as an external calibration standard; it can also be used for spiked-recovery experiments, LOD/LOQ determination, and LC-MS/MS multiple-reaction-monitoring (MRM) calibration.
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 | C14H12Cl2N4O5 |
| Molecular Weight | 387.17 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°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 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 4 |
Related Resmetirom Standards
- Resmetirom Impurity 126 (CAS CATO-C4X-2912126)
- Resmetirom Impurity 28 (CAS CATO-C4X-291228)
- Resmetirom Impurity 12 (CAS CATO-C4X-291212)
- Resmetirom impurity 58 (CAS CATO-C4X-291258)
- Resmetirom Impurity 27 (CAS CATO-C4X-291227)
- Resmetirom impurity 104 (CAS CATO-C4X-2912104)
- Resmetirom Impurity 40 (CAS 2947651-03-6)
- Resmetirom impurity 122 (CAS 2639977-02-7)
Recommended Standards
- Ethyl 5-amino-4-iodo-1-(4-methoxyphenyl)-1H-pyrazole-3-carboxylate (CAS 1427013-20-4)
- ((2R,3S,5R)-5-(4-Amino-2-oxopyrimidin-1(2H)-yl)-3-(phosphonooxy)tetrahydrofuran-2-yl)methyl dihydrogen phosphate (CAS 4682-43-3)
- Dibutyldiphenyltin (CAS 6452-61-5)
- ((2R,3S,5R)-5-(4-amino-2-oxopyrimidin-1(2H)-yl)-3-hydroxytetrahydrofuran-2-yl)methyl trihydrogen diphosphate (CAS 800-73-7)
- Iguratimod Impurity 63 (CAS CATO-C4X-182663)
- Tenapanor impurity 1 (CAS 1631730-06-7)
- Abiraterone Impurity 54 (CAS 1470276-23-3)
- 30-(((E)-1,3-Dihydroxyoctadec-4-en-2-yl)amino)-30-oxotriacontyl (9Z,12Z)-octadeca-9,12-dienoate (CAS 97040-38-5)
- 4-(4-Fluorobenzoyl)-3-hydroxy-5-(4-isopropylphenyl)-1-(5-methyl-1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one (CAS 439947-55-4)
- 4-Formyl-1-methyl-5-oxo-4,5-dihydro-1H-pyrazole-3-carbonitrile (CAS 142966-21-0)
- 9-Phenylanthracene (CAS 602-55-1)
- m-PEG3-S-Acetyl (CAS 857284-78-7)
- 2-(Thiophen-2-yl)-1h-benzo[d]imidazol-5-amine (CAS 51759-47-8)
- 141801-03-8 IL-1 Receptor Peptide (human) (CAS 141801-03-8)
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