(S)-3-(4-BROMO-3-FLUOROPHENYL)-2-((TERT-BUTOXYCARBONYL)AMINO)PROPANOIC ACID CAS 1998592-55-4
| CAS No. | 1998592-55-4 |
| Molecular Formula | C14H17BrFNO4 |
| Molecular Weight | 362.19 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of (S)-3-(4-BROMO-3-FLUOROPHENYL)-2-((TERT-BUTOXYCARBONYL)AMINO)PROPANOIC ACID is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies (S)-3-(4-BROMO-3-FLUOROPHENYL)-2-((TERT-BUTOXYCARBONYL)AMINO)PROPANOIC ACID (CAS 1998592-55-4), a certified reference material (molecular formula C14H17BrFNO4, MW 362.19 g/mol) for analytical method development and quality control.
Based on its molecular formula C14H17BrFNO4, (S)-3-(4-BROMO-3-FLUOROPHENYL)-2-((TERT-BUTOXYCARBONYL)AMINO)PROPANOIC ACID contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 362.19 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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), (S)-3-(4-BROMO-3-FLUOROPHENYL)-2-((TERT-BUTOXYCARBONYL)AMINO)PROPANOIC ACID 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 | C14H17BrFNO4 |
| Molecular Weight | 362.19 g/mol |
| Appearance | Off-white to pale 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 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1996 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 1 |
Related S Standards
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Recommended Standards
- (S)-3-(3-bromo-5-fluorophenyl)-2-((tert-butoxycarbonyl)amino)propanoic acid (CAS 1997460-26-0)
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- 2-[2-bromo-5-(2,2,2-trifluoroethoxy)-[1,2,4]triazolo[1,5-a]pyridin-8-yl]propan-2-ol (CAS 2170792-96-6)
- 2-Chloro-1-(8-chloro-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl)-2,2-difluoroethan-1-one (CAS 1823183-01-2)
- 3-(Chloromethyl)-5-methoxybenzonitrile (CAS 1261851-29-9)
- (5-Methyl-6-morpholinopyridin-3-yl)methanol (CAS 1355203-83-6)
- 4-Bromo-2-methylisoindoline (CAS 159724-74-0)
- 2-(Ethylsulfanyl)-4-(4-methylphenyl)-1H,4H,5H-indeno[1,2-d]pyrimidin-5-one (CAS 383147-80-6)
- Tos-PEG3-C2-methyl ester (CAS 1239588-09-0)
- 898790-97-1 Cyclobutyl[3-(trifluoromethyl)phenyl]methanone DTXSID00642540 (CAS 898790-97-1)
- 2-((1,3,4-Thiadiazol-2-yl)thio)-1-(3-fluoro-4-methoxyphenyl)ethan-1-one (CAS 1152923-41-5)
- Vildagliptin Dione Impurity (CAS 1844894-70-7)
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