Methyl (2S,4S)-4-(4-iodophenoxy)-2-pyrrolidinecarboxylate hydrochloride CAS 1354486-87-5
| CAS No. | 1354486-87-5 |
| Molecular Formula | C12H14INO3 |
| Molecular Weight | N/A |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Methyl (2S,4S)-4-(4-iodophenoxy)-2-pyrrolidinecarboxylate hydrochloride (CAS 1354486-87-5), molecular formula C12H14INO3HCl and molecular weight 383.61 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, Methyl (2S,4S)-4-(4-iodophenoxy)-2-pyrrolidinecarboxylate hydrochloride (C12H14INO3HCl) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine/iodine 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 383.61 g/mol, it falls into the moderately-high-molecular-weight range. The presence of an aromatic ring or conjugated system gives the compound characteristic absorption bands in the UV-Vis region, making it well suited to UV or diode-array detection (DAD).
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 | C12H14INO3 HCl |
| Molecular Weight | 383.61 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 chloroform, dichloromethane, ethyl acetate, DMSO |
| 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.) | 1991 |
| Halogen Content | Cl/I-containing |
| Nitrogen Atoms | 1 |
Recommended Standards
- 2-(2,5-Dimethylphenyl)quinoline-4-carbonyl chloride (CAS 1160264-72-1)
- (Z)-ethyl 2-((6aR,8R,9aS)-8-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-2,2,4,4-tetraisopropyl-6H-furo[3,2-f][1,3,5,2,4]trioxadisilocin-9(6aH,8H,9aH)-ylidene)acetate (CAS 185556-78-9)
- Di-tert-butyl(isopropyl)phosphine (CAS 25032-49-9)
- 5-Bromo-2-chloro-N-methyl-4-pyrimidinamine (CAS 205672-24-8)
- tert-Butyl (6-chloro-2-methylpyridin-3-yl)carbamate (CAS 1238324-80-5)
- 2-{[(tert-Butoxy)carbonyl]amino}-3-(piperidin-4-yl)propanoic acid (CAS 1021943-61-2)
- N'-(2-chloroacetyl)-3-(morpholinosulfonyl)benzohydrazide (CAS 790232-25-6)
- 2-Bromo-2,5-dimethylhexane (CAS 859193-18-3)
- 3-Ethyl-7-methylquinolin-2-amine (CAS 203506-21-2)
- Peptide Impurity (CAS CATO-CPTD788810)
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