(1S,4S)-2-(4-Trifluoromethylbenzyl)-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoro-acetic acid CAS 1208076-14-5
| CAS No. | 1208076-14-5 |
| Molecular Formula | C13H15F3N2 |
| Molecular Weight | N/A |
| 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 (1S,4S)-2-(4-Trifluoromethylbenzyl)-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoro-acetic acid.
(1S,4S)-2-(4-Trifluoromethylbenzyl)-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoro-acetic acid (CAS 1208076-14-5) is a high-purity analytical reference standard with the molecular formula C13H15F3N2C2HF3O2 and a molecular weight of 370.29 g/mol.
Based on its molecular formula C13H15F3N2C2HF3O2, (1S,4S)-2-(4-Trifluoromethylbenzyl)-2,5-diaza-bicyclo[2.2.1]heptane di-trifluoro-acetic acid contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution; these features give the compound characteristic absorption bands in UV spectroscopy. The molecular weight of 370.29 g/mol is directly relevant to the identification of the molecular ion in mass spectrometry. The high carbon-to-hydrogen ratio imparts good lipophilicity, allowing liquid-liquid extraction with non-polar solvents such as n-hexane or ethyl acetate.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
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 | C13H15F3N2 2*C2HF3O2 |
| Molecular Weight | 370.29 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 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1990 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Recommended Standards
- N-(2,2-diethylbutyl)thietan-3-amine (CAS 1862787-29-8)
- 1,2-Naphtoquinone-4-sulfonic acid Potassium salt (CAS 5908-27-0)
- 5,7-Dichloro-2-phenylquinolin-4-ol (CAS 1070879-77-4)
- 4,6-Dichloro-2-(4-fluoro-phenyl)-quinazoline (CAS 461036-88-4)
- <SC>L</SC>-Cysteine methyl ester hydrochloride (CAS 18598-63-5)
- (R)-N-((S)-1-Cyclopropyl-2,2,2-trifluoroethyl)-2-methylpropane-2-sulfinamide (CAS 2230871-70-0)
- 2-hexyldecyl (CAS 62314-50-5)
- 5-Nitro-1H-imidazol-4-amine (CAS 82039-90-5)
- 4-(4-(Benzyloxy)phenyl)butan-2-one (CAS 74432-58-9)
- Endo-Gly4-Semaglutide (CAS CATO-C4X-222679)
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