Ethyl 2-(6-bromo-3-cyano-2-(trifluoromethyl)phenyl)acetate CAS 1805585-99-2
| CAS No. | 1805585-99-2 |
| Molecular Formula | C12H9BrF3NO2 |
| Molecular Weight | 336.10 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
Ethyl 2-(6-bromo-3-cyano-2-(trifluoromethyl)phenyl)acetate (CAS 1805585-99-2), molecular formula C12H9BrF3NO2 and molecular weight 336.10 g/mol, is a CATO reference standard with documented purity and traceability.
Ethyl 2-(6-bromo-3-cyano-2-(trifluoromethyl)phenyl)acetate (C12H9BrF3NO2) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine/bromine substitution. Halogen substitution raises its density and boiling point, its high carbon-to-hydrogen ratio confers good lipid solubility, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. 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).
As a certified reference material (CRM), Ethyl 2-(6-bromo-3-cyano-2-(trifluoromethyl)phenyl)acetate 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 | C12H9BrF3NO2 |
| Molecular Weight | 336.10 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 |
| 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) | 7.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1995 |
| Halogen Content | F/Br-containing |
| Nitrogen Atoms | 1 |
Related Ethyl Standards
- Ethyl 2-(3-bromo-2-cyano-4-(trifluoromethyl)phenyl)acetate (CAS 1804407-32-6)
- Ethyl 2-(4-bromo-2-cyano-3-(trifluoromethyl)phenyl)acetate (CAS 1804407-50-8)
- Ethyl 2-(3-bromo-2-cyano-6-(trifluoromethyl)phenyl)acetate (CAS 1805101-18-1)
- Ethyl 2-(3-bromo-6-cyano-2-(trifluoromethyl)phenyl)acetate (CAS 1805101-25-0)
- Ethyl 2-(5-bromo-2-cyano-4-(trifluoromethyl)phenyl)acetate (CAS 1805101-47-6)
- Ethyl 2-(2-bromo-3-cyano-4-(trifluoromethyl)phenyl)acetate (CAS 1805187-87-4)
- Ethyl 2-(3-bromo-4-cyano-2-(trifluoromethyl)phenyl)acetate (CAS 1805188-08-2)
- Ethyl 2-(5-bromo-2-cyano-3-(trifluoromethyl)phenyl)acetate (CAS 1805188-29-7)
Recommended Standards
- Ethyl 2-(3-bromo-2-cyano-5-(trifluoromethyl)phenyl)acetate (CAS 1805585-72-1)
- (S)-5-(aminomethyl)-3-(3-fluoro-4-iodophenyl)oxazolidin-2-one (CAS 627543-03-7)
- Ethyl 2-(2-bromo-4-cyano-5-(trifluoromethyl)phenyl)acetate (CAS 1805585-51-6)
- 3-Chloro-5-(5-chlorofuran-2-yl)-2-methyl-7-(trifluoromethyl)pyrazolo[1,5-a]pyrimidine (CAS 439120-59-9)
- n-(4-Methoxybenzyl)-2-(4-phenylpiperazin-1-yl)acetamide (CAS 882749-06-6)
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