Methyl 3-bromo-4-(piperidin-1-yl)benzoate CAS 1131594-44-9
| CAS No. | 1131594-44-9 |
| Molecular Formula | C13H16BrNO2 |
| Molecular Weight | 298.18 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 298.18 g/mol gives Methyl 3-bromo-4-(piperidin-1-yl)benzoate distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
CATO supplies Methyl 3-bromo-4-(piperidin-1-yl)benzoate (CAS 1131594-44-9), a certified reference material (molecular formula C13H16BrNO2, MW 298.18 g/mol) for analytical method development and quality control.
The molecular framework of Methyl 3-bromo-4-(piperidin-1-yl)benzoate (C13H16BrNO2) is characterized by a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, bromine substitution. In reversed-phase chromatography, its retention is governed primarily by its high hydrophobicity (logP), which provides a practical basis for HPLC-UV/DAD or LC-MS method development. 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.
CATO manufactures Methyl 3-bromo-4-(piperidin-1-yl)benzoate under ISO 17034:2016 accreditation with dual CNAS and ANAB accreditation. Each batch is characterized by orthogonal methods and supplied with a full Certificate of Analysis (COA), ensuring metrological traceability.
Physical & Chemical Properties
| Molecular Formula | C13H16BrNO2 |
| Molecular Weight | 298.18 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, keep tightly closed to prevent evaporation |
| 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 | Br-containing |
| Nitrogen Atoms | 1 |
Related Methyl Standards
- 4-Bromo-5-((2-(cyclohex-1-en-1-yl)ethyl)amino)pyridazin-3(2h)-one (CAS 1008351-60-7)
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- N-(4-bromo-3-methylphenyl)tetrahydro-2H-pyran-4-carboxamide (CAS 1094378-03-6)
- Ethyl 3-bromo-4-(pyrrolidin-1-yl)benzoate (CAS 1131594-39-2)
- 3-Bromo-4-(4-methylpiperidin-1-yl)benzoic acid (CAS 1131594-40-5)
- 3-Bromo-4-(2-methylpiperidin-1-yl)benzoic acid (CAS 1131594-41-6)
- 3-Bromo-4-(piperidin-1-ylmethyl)benzoic acid (CAS 1131594-42-7)
- 3-Bromo-4-(cyclohexylamino)benzoic acid (CAS 1131594-43-8)
Recommended Standards
- 3-Bromo-4-(3-methylpiperidin-1-yl)benzoic acid (CAS 1131622-53-1)
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- n-(4-Bromophenyl)-3-(tetrahydrofuran-2-yl)propanamide (CAS 1147643-58-0)
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