Description

3-Bromo-2-fluoroaniline (CAS No. 58534-95-5) is a high-purity halogenated aniline derivative with the molecular formula C₆H₅BrFN. This aromatic amine features both bromo and fluoro substituents on the benzene ring, offering unique reactivity for electrophilic substitution and cross-coupling reactions. Ideal for pharmaceutical intermediates, agrochemical synthesis, and materials science research, our product is rigorously tested to ensure ≥98% purity (HPLC/GC). Supplied as a light-sensitive, pale-yellow to amber crystalline solid with a characteristic amine odor. Store under inert atmosphere at 2-8°C to prevent decomposition. Available in research (1g-25g) and bulk (100g-1kg) quantities with customizable packaging. SDS and CoA provided upon request.

Properties

• CAS Number: 58534-95-5
• Complexity: 99.1
• IUPAC Name: 3-bromo-2-fluoro-aniline
• InChI: InChI=1S/C6H5BrFN/c7-4-2-1-3-5(9)6(4)8/h1-3H,9H2
• InChI Key: HYPQOSVTIONWSN-UHFFFAOYSA-N
• Exact Mass: 188.95894
• Molecular Formula: C6H5BrFN
• Molecular Weight: 190.01
• SMILES: C1=CC(=C(C(=C1)Br)F)N
• Topological: 26
• Monoisotopic Mass: 188.95894
• Synonyms: 3-Bromo-2-fluoroaniline, 58534-95-5, 3-bromo-2-fluorobenzenamine, DTXSID90625004, DTXCID90575757, 820-692-5, 3-bromo-2-fluorophenylamine, MFCD09864700, 3-Brome-2-fluoroaniline, Benzenamine, 3-bromo-2-fluoro-, 3-Bromo-2-fluoro-phenylamine, SCHEMBL123021, SCHEMBL1384320, CL8412, SBB091035, AKOS006345737, CS-W004725, FB74779, PB43109, PS-8403, AC-28511, SY011957, DB-023552, EN300-105104

Application

3-Bromo-2-fluoroaniline serves as a versatile building block in medicinal chemistry for synthesizing fluorinated drug candidates, particularly kinase inhibitors and antipsychotic agents. Its orthogonal halogen substituents enable sequential Suzuki-Miyaura couplings in complex molecule assembly. The compound is also employed in agrochemical research for developing novel pesticides with enhanced bioactivity. Researchers utilize it as a precursor for fluorescent dyes and liquid crystal materials due to its electron-withdrawing halogen moieties.

Safety and Hazards

GHS Hazard Statements

• H301 (33.3%): Toxic if swallowed [Danger Acute toxicity, oral]
• H302 (66.7%): Harmful if swallowed [Warning Acute toxicity, oral]
• H311 (33.3%): Toxic in contact with skin [Danger Acute toxicity, dermal]
• H312 (33.3%): Harmful in contact with skin [Warning Acute toxicity, dermal]
• H315 (66.7%): Causes skin irritation [Warning Skin corrosion/irritation]
• H319 (66.7%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H331 (33.3%): Toxic if inhaled [Danger Acute toxicity, inhalation]
• H332 (33.3%): Harmful if inhaled [Warning Acute toxicity, inhalation]
• H335 (66.7%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

• P261, P262, P264, P264+P265, P270, P271, P280, P301+P316, P301+P317, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P321, P330, P332+P317, P337+P317, P361+P364, P362+P364, P403+P233, P405, and P501

Hazard Classes and Categories

• Acute Tox. 3 (33.3%)
• Acute Tox. 4 (66.7%)
• Acute Tox. 3 (33.3%)
• Acute Tox. 4 (33.3%)
• Skin Irrit. 2 (66.7%)
• Eye Irrit. 2A (66.7%)
• Acute Tox. 3 (33.3%)
• Acute Tox. 4 (33.3%)
• STOT SE 3 (66.7%)

If you are interested or have any questions, please contact us at support@atomfair.com

Disclaimer: Sold exclusively for laboratory research. Prohibited for commercial use, diagnostics, or human/animal applications. Buyers assume all compliance liability.