2-[(2-Chloroacetyl)amino]-3-methylbenzoic Acid Methyl Ester CAS 77093-79-9
| CAS No. | 77093-79-9 |
| Molecular Formula | C11H12ClNO3 |
| Molecular Weight | 241.67 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 2-[(2-Chloroacetyl)amino]-3-methylbenzoic Acid Methyl Ester.
2-[(2-Chloroacetyl)amino]-3-methylbenzoic Acid Methyl Ester (CAS 77093-79-9), molecular formula C11H12ClNO3 and molecular weight 241.67 g/mol, is a CATO reference standard with documented purity and traceability.
Structurally, 2-[(2-Chloroacetyl)amino]-3-methylbenzoic Acid Methyl Ester (C11H12ClNO3) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, chlorine 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 241.67 g/mol, it falls into the medium-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).
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.
As a certified reference material (CRM), 2-[(2-Chloroacetyl)amino]-3-methylbenzoic Acid Methyl Ester meets the metrological traceability requirements of ISO/IEC 17025 laboratories. Batch-to-batch consistency is monitored via control charts to guarantee comparable assigned values across lots.
Physical & Chemical Properties
| Molecular Formula | C11H12ClNO3 |
| Molecular Weight | 241.67 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 sealed and dry, keep tightly closed to prevent evaporation |
| Solubility (reference) | Soluble in methanol, ethanol, 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) | 6.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1979 |
| Halogen Content | Cl-containing |
| Nitrogen Atoms | 1 |
Related Chloroacetyl Standards
- (2-Chloroacetyl)-D-phenylalanine (CAS 137503-97-0)
- (2-Chloroacetyl)-L-phenylalanine (CAS 721-65-3)
- Methyl 3-{[(chloroacetyl)amino]methyl}benzoate (CAS 74553-27-8)
- N-Chloroacetyl-DL-phenylalanine (CAS 7765-11-9)
- 6-(2-Chloroacetyl)-7-fluoro-1,2,3,4-tetrahydroquinolin-2-one (CAS 148136-15-6)
- 6-(2-Chloroacetyl)-2H-benzo[b][1,4]thiazin-3(4H)-one (CAS 145736-61-4)
- 4-(2-Chloroacetyl)-2H-benzo[b][1,4]thiazin-3(4H)-one (CAS 68321-41-5)
- N-(2-chloroacetyl)-3-nitrobenzamide (CAS 568555-83-9)
Recommended Standards
- 1-Chloro-2-(cyclopropylmethoxy)-4-methyl-5-nitro-benzene (CAS 2231675-23-1)
- 2-Acetamido-3-(2-chlorophenyl)propanoic acid (CAS 6955-12-0)
- 1-(6-Chloropyrimidin-4-yl)piperidine-4-carboxylic acid (CAS 939986-75-1)
- 2-Acetamido-3-(3-chlorophenyl)propanoic acid (CAS 444726-89-0)
- 14885-78-0 D3O72MY557 Indium In-113 Indium, isotope of mass 113 Indium-113 UNII-D3O72MY557 (CAS 14885-78-0)
- Methyl 3-oxo-3-(2,3,4,5-tetrafluorophenyl)propanoate (CAS 111630-16-1)
- N-methyl-4-pentylbenzamide (CAS 401587-39-1)
- 1-Methyl-N-(7-methylbenzo[1,2-d:3,4-d']bis(thiazole)-2-yl)-1H-pyrazole-5-carboxamide (CAS 1171482-70-4)
- 2-Chloro-4,6-dimethylpyrimidine-5-carboxylic acid (CAS 4786-60-1)
- Ammonium perfluorooctanesulfonate (CAS 29081-56-9)
- Tert-butyl ((3R,3aR,6S,6aR)-6-aminohexahydrofuro[3,2-b]furan-3-yl)carbamate (CAS 1570346-43-8)
- 2-(2,4-Dibromophenoxy)acetonitrile (CAS 60758-90-9)
- (3R,4R)-tert-butyl 3-(dimethylamino)-4-hydroxypyrrolidine-1-carboxylate (CAS 960289-56-9)
- Semaglutide impurity 193 (CAS CATO-C4X-2226193)
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