Methyl 5-cyano-2-nitro-4-(trifluoromethyl)benzoate CAS 1805121-00-9
| CAS No. | 1805121-00-9 |
| Molecular Formula | C10H5F3N2O4 |
| Molecular Weight | 274.15 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
The occurrence of Methyl 5-cyano-2-nitro-4-(trifluoromethyl)benzoate is closely related to a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution in its molecular formula, which determines its behaviour during synthesis, purification, or degradation.
CATO supplies Methyl 5-cyano-2-nitro-4-(trifluoromethyl)benzoate (CAS 1805121-00-9), a certified reference material (molecular formula C10H5F3N2O4, MW 274.15 g/mol) for analytical method development and quality control.
Methyl 5-cyano-2-nitro-4-(trifluoromethyl)benzoate (C10H5F3N2O4) contains a nitrogen-containing heterocyclic scaffold, an amide group, a hydroxyl group, an ether linkage, fluorine substitution. It is notably hygroscopic, halogen substitution raises its density and boiling point, the carboxyl group imparts weak acidity; these physicochemical properties determine the optimal preparation and storage of its standard solutions. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
Recommended for analytical method development and validation; each product is supplied with a full Certificate of Analysis (COA) ensuring ISO 17034 metrological traceability.
As a certified reference material (CRM), Methyl 5-cyano-2-nitro-4-(trifluoromethyl)benzoate 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 | C10H5F3N2O4 |
| Molecular Weight | 274.15 g/mol |
| Appearance | Pale yellow to yellow crystalline powder. (slight halide-like odor, faint amine-like odor, low volatility) |
| 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) | 8.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1995 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Related Methyl Standards
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Recommended Standards
- 6-Trifluoromethoxychromone-2-carboxylic acid (CAS 174011-58-6)
- (1-((5-Bromofuran-2-yl)methyl)piperidin-3-yl)methanol (CAS 415719-61-8)
- 2-Oxo-6-(trifluoromethoxy)-2H-chromene-3-carboxylic acid (CAS 165685-08-5)
- [(5-Bromo-2-methoxyphenyl)methyl](2-methoxyethyl)amine (CAS 880812-26-0)
- 1-(2-Chloro-4-fluorobenzyl)-1H-pyrazole-4-carboxylic acid (CAS 1154882-21-9)
- 2-(chloromethyl)-5-(5-methyl-3-phenylisoxazol-4-yl)-1,3,4-oxadiazole (CAS 63002-59-5)
- 6,7-Dihydrothieno[3,2-c]pyridine-5(4h)-carbothioamide (CAS 953900-64-6)
- 5-Amino-1,2,3,4-tetrahydroisoquinoline Hydrochloride (CAS 1082658-92-1)
- (2S,3S)-Methyl 2-(benzylamino)-3-methylpentanoate hydrochloride (CAS 402929-56-0)
- 2-(3-(Ethoxycarbonyl)-5,6-dihydrocyclopenta[c]pyrazol-1(4H)-yl)acetic acid (CAS 2412008-48-9)
- 1-(4-Bromopiperidin-1-yl)ethanone (CAS 1082915-85-2)
- {2-methyl-2-azabicyclo[2.2.2]octan-6-yl}methanamine dihydrochloride (CAS 1909324-84-0)
- 5,7-Dichloro-8-fluoro-2-methylpyrido[4,3-d]pyrimidin-4(3H)-one (CAS 2763160-26-3)
- Cyclolinopeptide B (CAS 193139-41-2)
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