Methyl 5-iodo-2-(pyrrolidin-1-yl)benzoate CAS 1131587-38-6
| CAS No. | 1131587-38-6 |
| Molecular Formula | C12H14INO2 |
| Molecular Weight | 331.15 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.
Methyl 5-iodo-2-(pyrrolidin-1-yl)benzoate (CAS 1131587-38-6) is a high-purity analytical reference standard with the molecular formula C12H14INO2 and a molecular weight of 331.15 g/mol.
Structurally, Methyl 5-iodo-2-(pyrrolidin-1-yl)benzoate (C12H14INO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, iodine substitution. The molecule exhibits a degree of unsaturation (DBE) of 6.0, corresponding to approximately 6 ring(s) or double-bond equivalent(s). With a molecular weight of 331.15 g/mol, it falls into the moderately-high-molecular-weight range. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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.
Physical & Chemical Properties
| Molecular Formula | C12H14INO2 |
| Molecular Weight | 331.15 g/mol |
| Appearance | Off-white to pale yellow crystalline powder. (slight halide-like odor) |
| 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | I-containing |
| Nitrogen Atoms | 1 |
Related Methyl Standards
- 3-Iodo-4-(piperidin-1-yl)benzoic acid (CAS 1131614-26-0)
- Methyl 3-iodo-4-(pyrrolidin-1-yl)benzoate (CAS 1131614-28-2)
- 5-iodo-2-(piperidin-1-yl)benzoic acid (CAS 1521464-02-7)
- 2-Iodo-N-((tetrahydrofuran-2-yl)methyl)benzamide (CAS 333349-57-8)
- 4-Iodo-3-phenylisoquinoline (CAS 312612-62-7)
- 4-Iodo-N-((tetrahydrofuran-2-yl)methyl)benzamide (CAS 425606-62-8)
- 2-Iodo-4-phenylthiazole-5-carboxylic acid (CAS 1201811-11-1)
- 2-Iodo-N-(1,3,4-thiadiazol-2-yl)benzamide (CAS 342590-86-7)
Recommended Standards
- (2S,4R)-4-(4-Iodobenzyl)pyrrolidine-2-carboxylic acid (CAS 1049981-94-3)
- (2S,4R)-4-(3-Iodobenzyl)pyrrolidine-2-carboxylic acid (CAS 1049981-92-1)
- (2S,4R)-4-(2-Iodobenzyl)pyrrolidine-2-carboxylic acid (CAS 1049981-87-4)
- (R)-Methyl 5-iodo-2-(pyrrolidin-2-yl)benzoate (CAS 1217615-09-2)
- 2-methyltetrahydropyran-4-amine;hydrochloride (CAS 827046-87-7)
- 2-(Bromomethyl)-6-(methylthio)benzo[d]oxazole (CAS 1803795-69-8)
- 1-(5-hydroxypentyl)-N-tricyclo[3.3.1.13,7]dec-1-yl-1H-indazole-3-carboxamide 1778734-77-2 (CAS 1778734-77-2)
- 2-(2-Chloro-4,5-difluorophenyl)acetic acid (CAS 883502-00-9)
- Pasireotide Aspartate (CAS 820232-50-6)
- 4-Bromo-1,5-dimethyl-3-phenyl-1H-pyrazole (CAS 1523501-61-2)
- Ketoprofen EP Impurity F (CAS 42872-30-0)
- 5-(1,1-Dimethylethyl) 6-[[[(1,1-dimethylethyl)dimethylsilyl]oxy]methyl]-4,6-dihydro-1-methylpyrrolo[3,4-c]pyrazole-3,5(1H)-dicarboxylate (CAS 2792143-93-0)
- 2-(4-Oxo-5-(thiophen-2-ylmethylene)-2-thioxothiazolidin-3-yl)ethane-1-sulfonic acid (CAS 324564-39-8)
- [3,5 Diiodo-Tyr7] Peptide T (CAS 128551-40-6)
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