3-Iodo-4-((4-methylbenzyl)amino)benzoic acid CAS 1131614-91-9
| CAS No. | 1131614-91-9 |
| Molecular Formula | C15H14INO2 |
| Molecular Weight | 367.18 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
3-Iodo-4-((4-methylbenzyl)amino)benzoic acid (CAS 1131614-91-9) is a high-purity analytical reference standard with the molecular formula C15H14INO2 and a molecular weight of 367.18 g/mol.
Structurally, 3-Iodo-4-((4-methylbenzyl)amino)benzoic acid (C15H14INO2) 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 9.0, corresponding to approximately 9 ring(s) or double-bond equivalent(s). With a molecular weight of 367.18 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 | C15H14INO2 |
| Molecular Weight | 367.18 g/mol |
| Appearance | Pale yellow to 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) | 9.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1989 |
| Halogen Content | I-containing |
| Nitrogen Atoms | 1 |
Related Iodo Standards
- Benzyl (4-iodo-2-methylphenyl)carbamate (CAS 1259063-91-6)
- 3-Iodo-4-((4-methylbenzyl)oxy)benzamide (CAS 1706438-91-6)
- 2-Iodo-N-(4-methoxyphenyl)-N-methylbenzamide (CAS 36684-52-3)
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- methyl 8-iodo-3-nitro-naphthalene-1-carboxylate (CAS 2387598-89-0)
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Recommended Standards
- Phenethyl 2-amino-5-iodobenzoate (CAS 1131605-34-9)
- Methyl 2-(benzylamino)-5-iodobenzoate (CAS 1131587-21-7)
- 6-Bromo-2-(4-fluorobenzyl)-9-hydroxy-3,4-dihydro-2H-pyrido[1,2-a]pyrazine-1,8-dione (CAS 895133-42-3)
- (5-((4-Bromophenyl)thio)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-4-yl)methanol (CAS 318239-56-4)
- N-(4-Chlorophenyl)-2-((4-ethyl-5-(pyrazin-2-yl)-4H-1,2,4-triazol-3-yl)thio)acetamide (CAS 578736-90-0)
- 2-(4-((1H-Pyrazol-1-yl)methyl)phenyl)acetic acid (CAS 160388-51-2)
- 2-(2-Bromo-6-fluorophenyl)nicotinonitrile (CAS 1213704-92-7)
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