(2S)-2-{[(benzyloxy)carbonyl]amino}-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid CAS 1986906-46-0
| CAS No. | 1986906-46-0 |
| Molecular Formula | C16H16F3NO4 |
| Molecular Weight | 343.30 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
(2S)-2-{[(benzyloxy)carbonyl]amino}-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid (CAS 1986906-46-0) is a high-purity analytical reference standard with the molecular formula C16H16F3NO4 and a molecular weight of 343.30 g/mol.
The molecular framework of (2S)-2-{[(benzyloxy)carbonyl]amino}-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid (C16H16F3NO4) is characterized by a flavonoid core, an amide group, a hydroxyl group, an ether linkage, fluorine 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. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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), (2S)-2-{[(benzyloxy)carbonyl]amino}-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic 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 | C16H16F3NO4 |
| Molecular Weight | 343.30 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 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1996 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Related S Standards
- (2R)-2-{[(benzyloxy)carbonyl]amino}-2-[3-(trifluoromethyl)bicyclo[1.1.1]pentan-1-yl]acetic acid (CAS 1993319-93-9)
- 2-(2-(((Benzyloxy)carbonyl)amino)-6-oxo-3H-purin-9(6H)-yl)acetic acid (CAS 169287-69-8)
- 2-{[(benzyloxy)carbonyl]amino}-2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetic acid (CAS 73101-08-3)
- 2-(Benzyloxy)-7-phenylisoquinoline-1,3(2H,4H)-dione (CAS 1092801-83-6)
- 4-[4-(Benzyloxy)phenyl]-6-(furan-2-yl)pyrimidin-2-amine (CAS 1354929-97-7)
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Recommended Standards
- (Z,2Z)-2-(Methylimino)-N,N-dioxo-2-(pyrrolidin-1-yl)-N'-{[3-(trifluoromethyl)phenyl]amino}ethanimidamide (CAS 338416-91-4)
- 1-(Tert-butyl) 6-methyl 2-(trifluoromethyl)-1H-indole-1,6-dicarboxylate (CAS 1492900-83-0)
- 2-(4-(5-(Trifluoromethyl)pyridin-2-yl)piperazine-1-carbonyl)cyclopropane-1-carboxylic acid (CAS 913511-98-5)
- 1-Benzyl 2-methyl 2-(trifluoromethyl)-3,6-dihydropyridine-1,2(2h)-dicarboxylate (CAS 1262415-35-9)
- 1-(5-(4-Chlorophenyl)-2-methyl-1-phenyl-1H-pyrrol-3-yl)ethanone (CAS 100989-43-3)
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- 5-bromo-3-cyclopropanecarbonyl-1H-pyrrolo[2,3-b]pyridine (CAS 1691654-53-1)
- 1-(Pyridin-3-yl)cyclopropanecarboxylic acid (CAS 610791-39-4)
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