TERT-BUTYL 6-FLUORO-3-IODO-1H-INDOLE-1-CARBOXYLATE CAS 1627722-96-6
| CAS No. | 1627722-96-6 |
| Molecular Formula | C13H13FINO2 |
| Molecular Weight | 361.15 g/mol |
| 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 TERT-BUTYL 6-FLUORO-3-IODO-1H-INDOLE-1-CARBOXYLATE.
TERT-BUTYL 6-FLUORO-3-IODO-1H-INDOLE-1-CARBOXYLATE (CAS 1627722-96-6), molecular formula C13H13FINO2 and molecular weight 361.15 g/mol, is a CATO reference standard with documented purity and traceability.
TERT-BUTYL 6-FLUORO-3-IODO-1H-INDOLE-1-CARBOXYLATE (C13H13FINO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/iodine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. Halogen substitution (F/Cl/Br/I) produces a distinctive isotope pattern in mass spectrometry, a valuable aid for qualitative confirmation.
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 | C13H13FINO2 |
| Molecular Weight | 361.15 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 |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1993 |
| Halogen Content | F/I-containing |
| Nitrogen Atoms | 1 |
Recommended Standards
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