Tert-butyl 7-(trifluoromethyl)-2-azabicyclo[4.1.0]Heptane-2-carboxylate CAS 2382872-66-2
| CAS No. | 2382872-66-2 |
| Molecular Formula | C12H18F3NO2 |
| Molecular Weight | 265.27 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
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.
Tert-butyl 7-(trifluoromethyl)-2-azabicyclo[4.1.0]Heptane-2-carboxylate (CAS 2382872-66-2), molecular formula C12H18F3NO2 and molecular weight 265.27 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, Tert-butyl 7-(trifluoromethyl)-2-azabicyclo[4.1.0]Heptane-2-carboxylate (C12H18F3NO2) contains an amide group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution. The molecule exhibits a degree of unsaturation (DBE) of 3.0, corresponding to approximately 3 ring(s) or double-bond equivalent(s). With a molecular weight of 265.27 g/mol, it falls into the medium-molecular-weight range. 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.
Physical & Chemical Properties
| Molecular Formula | C12H18F3NO2 |
| Molecular Weight | 265.27 g/mol |
| Appearance | White to pale yellow crystalline powder. (slight halide-like odor, low volatility) |
| Purity | 97%+ |
| Storage | Store at 2-8°C, protect from light, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in chloroform, dichloromethane, ethyl acetate, DMSO |
| 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) | 3.0 |
| UV Absorption | UV-absorbing |
| CAS Registry Year (est.) | 1999 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 1 |
Recommended Standards
- Tert-butyl (S)-2-amino-2-(3-(trifluoromethyl)bicyclo[1.1.1]Pentan-1-yl)acetate (CAS 1987412-54-3)
- 5-(4'-methyl-[1,1'-biphenyl]-2-yl)-2-nitroso-2H-tetrazole (CAS CATO-C3D-26202)
- Tert-butyl (R)-2-amino-2-(3-(trifluoromethyl)bicyclo[1.1.1]Pentan-1-yl)acetate (CAS 1993320-34-5)
- 2'-Deoxy-N-methyladenosine (CAS 2002-35-9)
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- 2-pyrrolidin-3-yl-pyrimidine trihydrochloride (CAS 1020352-94-6)
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- (2R,3S,4R,5R)-2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-5-(hydroxymethyl)tetrahydrofuran-3,4-diyl diacetate (CAS 21016-88-6)
- 2-(3-Chloro-4-fluorophenyl)butan-2-ol (CAS 1379366-86-5)
- Peptide YY (3-36) (canine, mouse, porcine, rat) trifluoroacetate salt (CAS 126339-09-1)
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