4-Bromo-2-iodo-5-(trifluoromethyl)aniline CAS 868692-81-3
| CAS No. | 868692-81-3 |
| Molecular Formula | C7H4BrF3IN |
| Molecular Weight | 365.92 g/mol |
| Category | Pharmaceutical Standards / API Standards |
| Availability | In Stock |
Chemical Structure
Description
Compared with other compounds in its class, the molecular weight of 365.92 g/mol gives 4-Bromo-2-iodo-5-(trifluoromethyl)aniline distinctive chromatographic separation conditions and mass-spectrometry parameter settings.
4-Bromo-2-iodo-5-(trifluoromethyl)aniline (CAS 868692-81-3) is a high-purity analytical reference standard with the molecular formula C7H4BrF3IN and a molecular weight of 365.92 g/mol.
Structurally, 4-Bromo-2-iodo-5-(trifluoromethyl)aniline (C7H4BrF3IN) contains a nitrile group, fluorine/bromine/iodine substitution, an aromatic ring system. The molecule exhibits a degree of unsaturation (DBE) of 4.0, corresponding to approximately 4 ring(s) or double-bond equivalent(s). With a molecular weight of 365.92 g/mol, it falls into the moderately-high-molecular-weight range. 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.
The assigned purity is verified by mass-balance and quantitative NMR (qNMR) approaches, with the expanded uncertainty reported at a 95% confidence level (k=2). Batch homogeneity and stability are independently assessed for every lot.
Physical & Chemical Properties
| Molecular Formula | C7H4BrF3IN |
| Molecular Weight | 365.92 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 |
| Solubility (reference) | Soluble in methanol, acetonitrile, DMSO |
| Stability | May oxidize slowly on prolonged air exposure; Light-sensitive; avoid direct strong light |
| Degree of Unsaturation (DBE) | 4.0 |
| UV Absorption | UV-absorbing |
| Structural Features | Aromatic ring present |
| CAS Registry Year (est.) | 1987 |
| Halogen Content | F/Br/I-containing |
| Nitrogen Atoms | 1 |
Related Bromo Standards
- 3-Bromo-2-iodo-5-(trifluoromethyl)aniline (CAS 1100215-54-0)
- 5-Bromo-2-iodo-4-(trifluoromethyl)aniline (CAS 1373233-07-8)
- 4-Bromo-2-iodo-6-(trifluoromethyl)aniline (CAS 1807119-74-9)
- 2-Bromo-4-iodo-6-(trifluoromethyl)aniline (CAS 952901-54-1)
- 2-Bromo-6-iodo-4-(trifluoromethyl)aniline (CAS 875306-20-0)
- Methyl 3-bromo-5-cyano-2-iodobenzoate (CAS 1804406-18-5)
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Recommended Standards
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- 2-(Bromomethyl)-5-(difluoromethyl)-3-fluoro-4-iodopyridine (CAS 1807097-52-4)
- Methyl 3-bromo-4-cyano-2-iodobenzoate (CAS 1805017-31-5)
- 1-(2,3-Dihydro-1h-inden-2-yl)prop-2-en-1-one (CAS 195138-52-4)
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- Dulaglutide (CAS 923950-08-7)
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