N-(1-((2-Aminoethyl)thio)propan-2-yl)-6-methoxy-4-methyl-5-(3-(trifluoromethyl)phenoxy)quinolin-8-amine CAS 98586-86-8
| CAS No. | 98586-86-8 |
| Molecular Formula | C23H26F3N3O2S |
| Molecular Weight | 465.53 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Under current pharmacopoeial and regulatory frameworks, quality-control requirements for this class of reference material explicitly involve the control of targets including N-(1-((2-Aminoethyl)thio)propan-2-yl)-6-methoxy-4-methyl-5-(3-(trifluoromethyl)phenoxy)quinolin-8-amine.
N-(1-((2-Aminoethyl)thio)propan-2-yl)-6-methoxy-4-methyl-5-(3-(trifluoromethyl)phenoxy)quinolin-8-amine (CAS 98586-86-8), molecular formula C23H26F3N3O2S and molecular weight 465.53 g/mol, is a CATO reference standard with documented purity and traceability.
Based on its molecular formula C23H26F3N3O2S, N-(1-((2-Aminoethyl)thio)propan-2-yl)-6-methoxy-4-methyl-5-(3-(trifluoromethyl)phenoxy)quinolin-8-amine contains a steroid core, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 465.53 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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 | C23H26F3N3O2S |
| Molecular Weight | 465.53 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) | 11.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1985 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
| Sulfur Atoms | 1 |
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Recommended Standards
- 8-((5'-Amino-2'-Methyl-3'-Thiapentyl)Amino)-6-Methoxy-4-Methyl-5-((3-Trifluoromethyl)Phenoxy)Quinoline (CAS 98586-87-9)
- Pyrrolidine Hydrochloride (CAS 25150-61-2)
- 4-(1H-Benzo[d]imidazol-1-yl)-N-(4-(2-oxo-1,2,3,4-tetrahydroquinolin-6-yl)thiazol-2-yl)benzamide (CAS 1030769-75-5)
- Apremilast-d5 (CAS 1258597-47-5)
- 4-Amino-1-(pyridin-3-yl)butan-1-one hydrochloride (CAS 143228-73-3)
- 2-Methyl-6-phenoxypyridin-3-amine (CAS 875228-81-2)
- 59935-32-9 L-Serine-15N MFCD00144672 (CAS 59935-32-9)
- Bumetanide Impurity 43 (CAS 6633-36-9)
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- 1-Bromocyclohept-1-ene (CAS 18317-64-1)
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