Description

4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline (CAS No. 238098-26-5) is a high-purity fluorinated aromatic amine with the molecular formula C₁₀H₈F₇N. This specialized compound features a heptafluoropropan-2-yl group attached to a methyl-substituted aniline, offering unique electronic and steric properties for advanced synthetic applications. Its high fluorine content enhances lipophilicity and metabolic stability, making it valuable for pharmaceutical and agrochemical research. The compound is rigorously tested for quality (≥95% purity by HPLC) and is supplied in sealed, light-resistant packaging under inert gas to ensure stability. Ideal for use in cross-coupling reactions, ligand synthesis, and as a building block for fluorinated materials.

Properties

• CAS Number: 238098-26-5
• Complexity: 282
• IUPAC Name: 2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]aniline
• InChI: InChI=1S/C10H8F7N/c1-5-4-6(2-3-7(5)18)8(11,9(12,13)14)10(15,16)17/h2-4H,18H2,1H3
• InChI Key: QVAUOEHPYOFAQA-UHFFFAOYSA-N
• Exact Mass: 275.05449639
• Molecular Formula: C10H8F7N
• Molecular Weight: 275.17
• SMILES: CC1=C(C=CC(=C1)C(C(F)(F)F)(C(F)(F)F)F)N
• Topological: 26
• Monoisotopic Mass: 275.05449639
• Synonyms: 4-(1,1,1,2,3,3,3-Heptafluoropropan-2-yl)-2-methylaniline, DTXSID40432922, DTXCID10383750, 487-120-0, 238098-26-5, 2-Methyl-4-(1,1,1,2,3,3,3-heptafluoro-2-propyl)aniline, 2-methyl-4-heptafluoroisopropylaniline, MFCD13185889, 2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]aniline, C10H8F7N, 2-methyl-4-(heptafluoropropan-2-yl)-aniline, 2-methyl-4-(perfluoropropan-2-yl)benzenamine, Benzenamine, 2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-, SCHEMBL2718835, BCP14622, 2-METHYL-P-(1,2,2,2-TETRAFLUORO-1-TRIFLUOROMETHYLETHYL)PHENYLAMINE, AKOS005762850, DS-4267, 2-Methyl-4-(heptafluoroisopropyl)aniline, 2-Methyl-4-(perfluoro-2-propyl)aniline, SY106228, 4-(heptafluoro-2-propyl)-2-methylaniline, CS-0035943, NS00077892, EN300-1180021, 4-(HEPTAFLUOROPROPAN-2-YL)-2-METHYLANILINE, 2-methyl-4-(1,1,1,2,3,3,3-heptafluoro-2-propyl)anilin, 2-methyl-4-(1,2,2,2-tetrafluoro-1-trifluoromethylethyl)aniline, 2-methyl-4-(1,2,2,2-tetrafluoro-1-trifluoromethylethyl)phenylamine, 2-methyl-4-[1,2,2,2-tetrafluor-1-(trifluoromethyl)ethyl]aniline, 2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoro-methyl)ethyl]aniline, 2-methyl-4-[1,2,2,2-tetrafluoro-1-(trifluoromethyl)ethyl]-aniline, 2-methyl-4-(1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl)-phenyl-amine, 2-methyl-4-(1,2,2,2-tetrafluoro-1-trifluoromethyl-ethyl)-phenylamine, 2-methyl-4- pound 1 pound not1 pound not1 pound not2 pound not3 pound not3 pound not3-heptafluoro-2-propyl pound(c)aniline

Application

This fluorinated aniline derivative serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty materials. Its electron-withdrawing heptafluoropropyl group makes it valuable for designing bioactive molecules with enhanced stability. Researchers utilize it in Suzuki-Miyaura couplings and other palladium-catalyzed reactions to create complex fluorinated architectures. The compound is also employed in liquid crystal and polymer research due to its unique steric and electronic properties.

Safety and Hazards

GHS Hazard Statements

• H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
• H360 (100%): May damage fertility or the unborn child [Danger Reproductive toxicity]
• H373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]
• H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
• H410 (100%): Very toxic to aquatic life with long lasting effects [Warning Hazardous to the aquatic environment, long-term hazard]

Precautionary Statements

• P203, P260, P264, P270, P273, P280, P301+P317, P318, P319, P330, P391, P405, and P501

Hazard Classes and Categories

• Acute Tox. 4 (100%)
• Repr. 1B (100%)
• STOT RE 2 (100%)
• Aquatic Acute 1 (100%)
• Aquatic Chronic 1 (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.