4-((2-((tert-Butoxycarbonyl)amino)ethyl)sulfonyl)-3-fluoro-2-methylbenzoic acid CAS 2250061-92-6
| CAS No. | 2250061-92-6 |
| Molecular Formula | C15H20FNO6S |
| Molecular Weight | 361.39 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
CATO supplies 4-((2-((tert-Butoxycarbonyl)amino)ethyl)sulfonyl)-3-fluoro-2-methylbenzoic acid (CAS 2250061-92-6), a certified reference material (molecular formula C15H20FNO6S, MW 361.39 g/mol) for analytical method development and quality control.
Structurally, 4-((2-((tert-Butoxycarbonyl)amino)ethyl)sulfonyl)-3-fluoro-2-methylbenzoic acid (C15H20FNO6S) contains a nitrogen-containing heterocyclic scaffold, an amide group, a sulfone group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 361.39 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.
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 | C15H20FNO6S |
| Molecular Weight | 361.39 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; Contains ester bond; hydrolyzes under strong alkaline conditions |
| Degree of Unsaturation (DBE) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1998 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
| Sulfur Atoms | 1 |
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Recommended Standards
- 3-[(2,3-dimethoxyphenyl)methylidene]-1H,2H,3H-cyclopenta[b]quinoline-9-carboxylic acid (CAS 750617-49-3)
- 4-(2-Fluorophenyl)-5-(3,4,5-trimethoxyphenyl)-4h-1,2,4-triazole-3-thiol (CAS 728012-89-3)
- 3-(3,4-Dimethoxy-benzylidene)-2,3-dihydro-1H-cyclopenta[b]quinoline-9-carboxylic acid (CAS 379726-67-7)
- 4-Hydroxy-N'-[(1E)-(4-methylphenyl)methylidene]-2-oxo-1-azatricyclo[7.3.1.0^{5,13}]trideca-3,5(13),6,8-tetraene-3-carbohydrazide (CAS 477855-31-5)
- Diphenhydramine N-Oxide(hydrochloride) (CAS 13168-00-8)
- N-[1-(5-Carbamoyladamantan-2-ylamino)-1-oxo-2-methyl-2-propanyl]-2-fluorobenzenesulfonamid (CAS 1422025-27-1)
- 2,2-Difluoro-[1,3]dioxolo[4,5-c]pyridine-6-carboxylic acid (CAS 1546229-03-1)
- 5-(Benzyloxy)-2-(chloromethyl)-4H-pyran-4-one (CAS 89539-54-8)
- 2-(4-(((9H-fluoren-9-yl)methoxy)carbonyl)-2-oxo-3,4-dihydroquinoxalin-1(2H)-yl)acetic acid (CAS 269078-84-4)
- 2-(1H-indol-3-yl)-1-(piperazin-1-yl)ethan-1-one hydrochloride (CAS 1181458-97-8)
- 5-(6-Hydroxypyridin-3-yl)-1,2,4-oxadiazole-3-carboxylic acid (CAS 1697625-44-7)
- Methyl 3-Fluoro-4-(hydroxymethyl)benzoate (CAS 937636-18-5)
- 4-[2-(2-Isopropylphenoxy)ethyl]piperidinehydrochloride (CAS 1220028-74-9)
- Uremic Pentapeptide (CAS 71494-20-7)
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