Tert-butyl4,5,7,8-tetrahydro-2h-pyrazolo[3,4-d]azepine-6-carboxylate;2,2,2-trifluoroaceticacid CAS 2387602-00-6
| CAS No. | 2387602-00-6 |
| Molecular Formula | C12H19N3O2 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of Tert-butyl4,5,7,8-tetrahydro-2h-pyrazolo[3,4-d]azepine-6-carboxylate;2,2,2-trifluoroaceticacid 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 Tert-butyl4,5,7,8-tetrahydro-2h-pyrazolo[3,4-d]azepine-6-carboxylate;2,2,2-trifluoroaceticacid (CAS 2387602-00-6), a certified reference material (molecular formula C12H19N3O2C2HF3O2, MW 351.32 g/mol) for analytical method development and quality control.
Structurally, Tert-butyl4,5,7,8-tetrahydro-2h-pyrazolo[3,4-d]azepine-6-carboxylate;2,2,2-trifluoroaceticacid (C12H19N3O2C2HF3O2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 5.0, corresponding to approximately 5 ring(s) or double-bond equivalent(s). With a molecular weight of 351.32 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.
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
CATO manufactures Tert-butyl4,5,7,8-tetrahydro-2h-pyrazolo[3,4-d]azepine-6-carboxylate;2,2,2-trifluoroaceticacid under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C12H19N3O2 C2HF3O2 |
| Molecular Weight | 351.32 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) | 5.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1999 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 3 |
Recommended Standards
- 2-(3-Amino-4-chloro-1h-pyrazol-1-yl)-N-(sec-butyl)acetamide (CAS 1340179-26-1)
- 3-Bromo-5-chloro-2-fluoropyridine (CAS 884494-87-5)
- 6-Methoxy-1-methyl-1,2,3,4-tetrahydroisoquinoline (CAS 25939-83-7)
- (4E)-4-[(3-Chloro-4-methoxyphenyl)methylidene]-2-(2-iodophenyl)-4,5-dihydro-1,3-oxazol-5-one (CAS 861211-36-1)
- N-(2-Cyanophenyl)-2-(morpholin-4-yl)acetamide (CAS 189757-27-5)
- 4-(Cyclopropylamino)benzaldehyde (CAS 1228098-31-4)
- n-(3-Chlorophenyl)-2-(3-oxo-1,2,3,4-tetrahydroquinoxalin-2-yl)acetamide (CAS 318235-37-9)
- 2-Amino-4,6-dimethylnicotinamide (CAS 7144-20-9)
- 3-(4-Hydroxyphenyl)isonicotinic acid (CAS 1258625-94-3)
- Gastric Inhibitory Polypeptide (6-30) amide (human) (CAS 1139691-72-7)
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