Description

3-Fluoro-4-(trifluoromethoxy)benzylamine (CAS No. 886499-13-4) is a high-purity fluorinated aromatic amine with the molecular formula C₈H₇F₄NO. This compound, also known by its IUPAC name [3-fluoro-4-(trifluoromethoxy)phenyl]methanamine, is a versatile building block in organic synthesis and pharmaceutical research. Its unique structure, featuring both fluorine and trifluoromethoxy substituents, enhances its reactivity and potential as an intermediate in drug discovery, agrochemical development, and material science applications.

Our product is rigorously tested to ensure >98% purity (HPLC/GC) and is supplied as a clear, colorless to pale yellow liquid under controlled conditions. It is packaged in amber glass vials or bottles under inert atmosphere to ensure stability and longevity. Ideal for researchers requiring precise fluorinated scaffolds, this compound is compatible with a wide range of coupling reactions, reductive aminations, and heterocycle formations.

Key Features:
– High chemical purity (>98%)
– Fluorinated aromatic amine for enhanced bioactivity
– Suitable for nucleophilic substitutions and cross-coupling reactions
– Stable under inert storage conditions

Properties

• CAS Number: 886499-13-4
• Complexity: 185
• IUPAC Name: [3-fluoro-4-(trifluoromethoxy)phenyl]methanamine
• InChI: InChI=1S/C8H7F4NO/c9-6-3-5(4-13)1-2-7(6)14-8(10,11)12/h1-3H,4,13H2
• InChI Key: LKKOOHKPOMOOAI-UHFFFAOYSA-N
• Exact Mass: 209.04637650
• Molecular Formula: C8H7F4NO
• Molecular Weight: 209.14
• SMILES: C1=CC(=C(C=C1CN)F)OC(F)(F)F
• Topological: 35.3
• Monoisotopic Mass: 209.04637650
• Synonyms: 3-FLUORO-4-(TRIFLUOROMETHOXY)BENZYLAMINE, 886499-13-4, [3-fluoro-4-(trifluoromethoxy)phenyl]methanamine, MFCD06660207, (3-fluoro-4-(trifluoromethoxy)phenyl)methanamine, 1-[3-Fluoro-4-(trifluoromethoxy)phenyl]methanamine, 3-Fluoro-4-trifluoromethoxy-benzylamine, Benzenemethanamine,3-fluoro-4-(trifluoromethoxy)-, SCHEMBL2441170, DTXSID40590637, BBL101515, SBB094154, STL555311, 3-Fluoro-4-trifluoromethoxybenzylamine, AKOS005259546, SB78452, AC-25951, AS-33201, DB-088316, [3-fluoro-4-(trifluoromethoxy)phenyl]methylamine

Application

3-Fluoro-4-(trifluoromethoxy)benzylamine serves as a critical intermediate in medicinal chemistry for the synthesis of bioactive molecules, particularly in CNS-targeting pharmaceuticals due to its blood-brain barrier permeability. Its trifluoromethoxy group enhances metabolic stability, making it valuable in protease inhibitor and GPCR modulator development. The compound is also employed in agrochemical research for designing novel pesticides with improved efficacy.

Safety and Hazards

GHS Hazard Statements

• H314 (100%): Causes severe skin burns and eye damage [Danger Skin corrosion/irritation]

Precautionary Statements

• P260, P264, P280, P301+P330+P331, P302+P361+P354, P304+P340, P305+P354+P338, P316, P321, P363, P405, and P501

Hazard Classes and Categories

• Skin Corr. 1B (100%)

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