Get FREE SHIPPING when you spend $99 or more | ATOMFAIR

Awaiting product image

Atomfair 2-Methyl-4-(trifluoromethyl)benzeneboronic acid C8H8BF3O2 CAS 957034-45-6

2-Methyl-4-(trifluoromethyl)benzeneboronic acid (CAS: 957034-45-6) is a high-purity boronic acid derivative with the molecular formula C8H8BF3O2. This compound, also known by its IUPAC name [2-methyl-4-(trifluoromethyl)phenyl]boronic acid , is a versatile building block in organic synthesis and pharmaceutical research. Its unique structure, featuring a trifluoromethyl group and a boronic acid moiety, makes it invaluable for Suzuki-Miyaura cross-coupling reactions, enabling the formation of carbon-carbon bonds in complex molecular architectures. The product is supplied as a white to off-white crystalline powder with ≥95% purity (HPLC), ensuring consistent performance in sensitive applications. Store in a cool, dry place under inert conditions to maintain stability. Suitable…

Category:

Description

2-Methyl-4-(trifluoromethyl)benzeneboronic acid (CAS: 957034-45-6) is a high-purity boronic acid derivative with the molecular formula C8H8BF3O2. This compound, also known by its IUPAC name [2-methyl-4-(trifluoromethyl)phenyl]boronic acid, is a versatile building block in organic synthesis and pharmaceutical research. Its unique structure, featuring a trifluoromethyl group and a boronic acid moiety, makes it invaluable for Suzuki-Miyaura cross-coupling reactions, enabling the formation of carbon-carbon bonds in complex molecular architectures. The product is supplied as a white to off-white crystalline powder with ≥95% purity (HPLC), ensuring consistent performance in sensitive applications. Store in a cool, dry place under inert conditions to maintain stability. Suitable for use in medicinal chemistry, materials science, and agrochemical research.

Properties

  • CAS Number: 957034-45-6
  • Complexity: 196
  • IUPAC Name: [2-methyl-4-(trifluoromethyl)phenyl]boronic acid
  • InChI: InChI=1S/C8H8BF3O2/c1-5-4-6(8(10,11)12)2-3-7(5)9(13)14/h2-4,13-14H,1H3
  • InChI Key: USEHFBIGOATLIA-UHFFFAOYSA-N
  • Exact Mass: 204.0569441
  • Molecular Formula: C8H8BF3O2
  • Molecular Weight: 203.96
  • SMILES: B(C1=C(C=C(C=C1)C(F)(F)F)C)(O)O
  • Topological: 40.5
  • Monoisotopic Mass: 204.0569441
  • Synonyms: 2-Methyl-4-(trifluoromethyl)benzeneboronic acid, 801-225-4, 2-Methyl-4-(trifluoromethyl)phenylboronic acid, 957034-45-6, 2-METHYL-4-TRIFLUOROMETHYLPHENYLBORONIC ACID, [2-methyl-4-(trifluoromethyl)phenyl]boronic acid, Boronic acid, B-[2-methyl-4-(trifluoromethyl)phenyl]-, MFCD08689550, (2-methyl-4-(trifluoromethyl)phenyl)boronic acid, 2-Methyl-4-(trifluoromethyl)phenylboronicacid, SCHEMBL581357, DTXSID20659372, SBB071219, AKOS015842346, AB48274, PS-9471, SY026531, DB-010474, CS-0086797, 2-methyl-4-trifluoromethyl phenylboronic acid, EN300-822219, F15501, A845379, Z1269154154

Application

2-Methyl-4-(trifluoromethyl)benzeneboronic acid is widely used as a key intermediate in Suzuki-Miyaura cross-coupling reactions for the synthesis of biaryl compounds in pharmaceutical and material science research. Its trifluoromethyl group enhances the lipophilicity and metabolic stability of derived molecules, making it valuable in drug discovery. The compound is also employed in the development of liquid crystals and organic electronic materials due to its electron-withdrawing properties. Researchers utilize it to introduce trifluoromethyl-substituted aromatic rings into complex scaffolds.

Safety and Hazards

GHS Hazard Statements

  • H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
  • H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]

Precautionary Statements

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

Hazard Classes and Categories

  • Skin Irrit. 2 (100%)
  • Eye Irrit. 2A (100%)
  • STOT SE 3 (100%)

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.

Disclaimer

Intended Use & Restrictions

This product is sold exclusively for laboratory research, analytical testing, or non-commercial purposes.

  • Strictly prohibited: Resale, repackaging, or formulation into commercial products.
  • Not approved for human/animal use, diagnostics, or manufacturing (including pharmaceuticals, agrochemicals, or consumer goods).

Patent & Regulatory Compliance

Certain molecules may be protected by active patents or regulatory restrictions.

  • Buyers must independently verify patent status (e.g., via USPTO/EPO/CNIPA) and comply with local laws.
  • Atomfair LLC does not provide legal assurances regarding patent non-infringement or jurisdictional compliance.

Liability Release

By purchasing, the buyer agrees to:

  • Use this product only as permitted by law.
  • Indemnify Atomfair LLC against all claims arising from misuse, patent infringement, or regulatory violations.

Reviews

There are no reviews yet.

Only logged in customers who have purchased this product may leave a review.

Related products