1-(2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)-2,2,2-trifluoroethan-1-one CAS 2813867-36-4
| CAS No. | 2813867-36-4 |
| Molecular Formula | C13H16BF3N2O3 |
| Molecular Weight | 316.08 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of 1-(2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)-2,2,2-trifluoroethan-1-one is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies 1-(2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)-2,2,2-trifluoroethan-1-one (CAS 2813867-36-4), a certified reference material (molecular formula C13H16BF3N2O3, MW 316.08 g/mol) for analytical method development and quality control.
The molecular framework of 1-(2-Amino-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridin-3-yl)-2,2,2-trifluoroethan-1-one (C13H16BF3N2O3) is characterized by a nitrogen-containing heterocyclic scaffold, 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. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C13H16BF3N2O3 |
| Molecular Weight | 316.08 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) | 5.5 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2003 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Related Amino Standards
- 4-Amino-6-bromo-2-(trifluoromethyl)quinoline-3-carbonitrile (CAS 1209063-53-5)
- Ethyl 5-amino-4-bromo-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate (CAS 1427023-16-2)
- (Z)-4-Amino-N-(3-bromo-4-fluorophenyl)-N’-hydroxy-1,2,5-oxadiazole-3-carboximidamide (CAS 914638-30-5)
- Methyl 2-amino-4-bromo-3-fluoro-5-(trifluoromethyl)benzoate (CAS 2823478-54-0)
- 2-Amino-7-bromo-5-oxo-5H-chromeno[2,3-b]pyridine-3-carbonitrile (CAS 206658-80-2)
- 1-Amino-3-bromo-2-methylanthracene-9,10-dione (CAS 10165-29-4)
- 3-amino-6-bromo-2-phenylquinazolin-4(3H)-one (CAS 115754-65-9)
- 1-Amino-4-bromo-2-methyl-9,10-dihydroanthracene-9,10-dione (CAS 81-50-5)
Recommended Standards
- 7-Bromo-6-fluoro-8-methoxy-4-oxo-1,4-dihydroquinoline-3-carboxylic acid (CAS 1956310-19-2)
- 2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethoxy)benzaldehyde (CAS 2121513-88-8)
- 2-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-5-(trifluoromethyl)benzoic acid (CAS 2377607-44-6)
- 2-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)benzoic acid (CAS 1400976-18-2)
- 3-Chloro-4-(3'-bromobenzyloxy)phenylboronic acid (CAS 849062-25-5)
- 1,3-Benzenedicarboxylic acid, polymer with 5-amino-1,3,3-trimethylcyclohexanemethanamine and hexahydro-2H-azepin-2-one (CAS 29009-00-5)
- Furo[3,4-b]benzofuran (CAS 247-11-0)
- Roxatidine Impurity 47 (CAS 4530-46-5)
- (6S)-1-[[4-[bis(trideuteriomethyl)amino]-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid;2,2,2-trifluoroacetic acid (CAS 1346603-57-3)
- 1-[2-(2-fluorophenyl)-4-methyl-1,3-thiazol-5-yl]ethan-1-one (CAS 842115-55-3)
- Folic Acid Impurity 72 (CAS CATO-C4X-139572)
- Sitafloxacin hydrate (CAS 163253-35-8)
- Salbutamol 4-O-sulfate (CAS 63908-03-2)
- Semaglutide Impurity 144 (CAS 394210-59-4)
Why CATO?
- ISO 17034 accredited reference material producer (CNAS + ANAB dual accreditation)
- 130,000+ catalog items in stock, COA supplied with every batch
- Worldwide shipping with full export documentation (HS code guidance available)
- Technical support: +86 18665070610 / Nicole.chen@cato-chem.com