3,5-Dinitrobenzotrifluoride CAS 401-99-0
| CAS No. | 401-99-0 |
| Molecular Formula | C7H3F3N2O4 |
| Molecular Weight | 236.10 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 3,5-Dinitrobenzotrifluoride.
CATO supplies 3,5-Dinitrobenzotrifluoride (CAS 401-99-0), a certified reference material (molecular formula C7H3F3N2O4, MW 236.10 g/mol) for analytical method development and quality control.
Owing to an amide group, a carboxylic acid group, a hydroxyl group, an ether linkage, fluorine substitution, an aromatic ring system, 3,5-Dinitrobenzotrifluoride is typically off-white to pale yellow crystalline powder. Its solid-state physicochemical attributes — including a molecular weight of 236.10 g/mol — guide the selection of appropriate sample preparation and analytical techniques. The aromatic system may exhibit native fluorescence, enabling detection with a fluorescence detector (FLD).
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), 3,5-Dinitrobenzotrifluoride 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 | C7H3F3N2O4 |
| Molecular Weight | 236.10 g/mol |
| Appearance | Off-white to pale 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, water |
| 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.) | 1957 |
| Halogen Content | F-containing |
| Nitrogen Atoms | 2 |
Recommended Standards
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- 2,4-Dichloro-5-(2-methoxyethoxy)aniline (CAS 339278-77-2)
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- 1-((4-Chlorobenzyl)amino)-2-methylpropan-2-ol (CAS 1183690-96-1)
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- Ethyl 2-(4-((4-bromo-5-(dimethylcarbamoyl)thiazol-2-yl)oxy)phenoxy)propanoate (CAS 1000575-49-4)
- (E)-N-(4-chlorobenzyl)-3-(4-isobutylphenyl)acrylamide (CAS 329778-75-8)
- (S)-3-benzyl-4,5,6,7-tetrahydro-3H-imidazo[4,5-c]pyridine-6-carboxylic acid (CAS 768322-42-5)
- 5-Phenyl-1H-pyrrolo[2,3-b]pyridin-2-amine (CAS 1261561-56-1)
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- 1-Allyl-2-chloro-4-fluorobenzene (CAS 128426-47-1)
- Peptide-GMF (CAS CATO-CPTD788469)
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