Tert-butyl (3aR,6aR)-5-(2,2,2-trifluoroacetyl)hexahydropyrrolo[3,4-b]pyrrole-1(2H)-carboxylate CAS 370880-08-3
| CAS No. | 370880-08-3 |
| Molecular Formula | C13H19F3N2O3 |
| Molecular Weight | 308.30 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
CATO supplies Tert-butyl (3aR,6aR)-5-(2,2,2-trifluoroacetyl)hexahydropyrrolo[3,4-b]pyrrole-1(2H)-carboxylate (CAS 370880-08-3), a certified reference material (molecular formula C13H19F3N2O3, MW 308.30 g/mol) for analytical method development and quality control.
Owing to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution, Tert-butyl (3aR,6aR)-5-(2,2,2-trifluoroacetyl)hexahydropyrrolo[3,4-b]pyrrole-1(2H)-carboxylate is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 308.30 g/mol — guide the selection of appropriate sample preparation and analytical techniques. Nitrogen-containing functional groups confer excellent ionization efficiency in positive-ion electrospray (ESI) mode, making the compound well suited to LC-MS/MS analysis.
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 | C13H19F3N2O3 |
| Molecular Weight | 308.30 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) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 2025 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Recommended Standards
- N-(4,6-Difluorobenzo[d]thiazol-2-yl)-N-(furan-2-ylmethyl)acetamide (CAS 922371-33-3)
- Tert-butyl 1-((2,2,2-trifluoroacetamido)methyl)-2-azabicyclo[2.1.1]Hexane-2-carboxylate (CAS 2252380-51-9)
- Methyl 1-(2-fluoro-4-(hydroxymethyl)benzyl)-3-(methoxymethyl)-1H-pyrazole-4-carboxylate (CAS 2345657-34-1)
- tert-Butyl 3-(2,2,2-trifluoroacetyl)-3,8-diazabicyclo[3.2.1]octane-8-carboxylate (CAS 824982-19-6)
- (+/-)-β-Santalene (CAS 37876-50-9)
- 1-Butoxy-5-chloro-2,4-difluorobenzene (CAS 1881331-93-6)
- (4-Chlorophenyl)(2,4-dihydroxyphenyl)methanone (CAS 18239-10-6)
- Ethyl 5-bromo-1-(4-methoxybenzyl)-1H-pyrrole-2-carboxylate (CAS 1198805-14-9)
- tert-Butyl acryloylcarbamate (CAS 103223-89-8)
- 3-Benzyl-2,3-dihydrobenzofuran (CAS 72374-36-8)
- Tert-butyl 8-(hydroxymethyl)-5-azaspiro[2.5]Octane-5-carboxylate (CAS 2411641-73-9)
- 1-N-methylbenzene-1,4-disulfonamide (CAS 1138-53-0)
- SCH 39166 Hydrobromide (CAS 1227675-51-5)
- Tau Peptide (307-321) trifluoroacetate salt (CAS 330456-50-3)
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