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

Awaiting product image

Atomfair 3-Acetylbenzoic acid C9H8O3 CAS 586-42-5

3-Acetylbenzoic Acid (CAS 586-42-5) is a high-purity organic compound with the molecular formula C9H8O3. This white to off-white crystalline powder is widely used in pharmaceutical and chemical research due to its dual functional groups (acetyl and carboxylic acid), making it a versatile intermediate for synthesis. With a purity of ≥98%, our product is rigorously tested via HPLC, GC, and NMR to ensure consistency and reliability. Ideal for organic synthesis, medicinal chemistry, and material science applications, 3-Acetylbenzoic Acid is packaged under inert conditions to guarantee stability and longevity. Available in quantities ranging from grams to kilograms, it is supplied with comprehensive…

Category:

Description

3-Acetylbenzoic Acid (CAS 586-42-5) is a high-purity organic compound with the molecular formula C9H8O3. This white to off-white crystalline powder is widely used in pharmaceutical and chemical research due to its dual functional groups (acetyl and carboxylic acid), making it a versatile intermediate for synthesis. With a purity of ≥98%, our product is rigorously tested via HPLC, GC, and NMR to ensure consistency and reliability. Ideal for organic synthesis, medicinal chemistry, and material science applications, 3-Acetylbenzoic Acid is packaged under inert conditions to guarantee stability and longevity. Available in quantities ranging from grams to kilograms, it is supplied with comprehensive analytical data (COA, MSDS) for regulatory compliance.

Properties

  • CAS Number: 586-42-5
  • Complexity: 198
  • IUPAC Name: 3-acetylbenzoic acid
  • InChI: InChI=1S/C9H8O3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5H,1H3,(H,11,12)
  • InChI Key: CHZPJUSFUDUEMZ-UHFFFAOYSA-N
  • Exact Mass: 164.047344113
  • Molecular Formula: C9H8O3
  • Molecular Weight: 164.16
  • SMILES: CC(=O)C1=CC(=CC=C1)C(=O)O
  • Topological: 54.4
  • Monoisotopic Mass: 164.047344113
  • Synonyms: 3-Acetylbenzoic acid, 586-42-5, CHZPJUSFUDUEMZ-UHFFFAOYSA-, DTXSID40277572, DTXCID30228730, 629-958-3, inchi=1/c9h8o3/c1-6(10)7-3-2-4-8(5-7)9(11)12/h2-5h,1h3,(h,11,12), m-acetylbenzoic acid, Benzoic acid, 3-acetyl-, 3-Acetophenonecarboxylic Acid, MFCD00045847, 3′-Acetophenonecarboxylic Acid, 3-(1-Oxoethyl)benzoic acid, 3-Acetylbenzoicacid, NSC2932, ACETOPHENONE-3-CARBOXYLIC ACID, 3-acetyl benzoic acid, 3-acetyl-benzoic acid, 3-Acetylbenzoic acid, 98%, Benzoyl methide-m-carboxylic;, SCHEMBL246827, SCHEMBL27987408, CHZPJUSFUDUEMZ-UHFFFAOYSA-N, ALBB-006410, NSC-2932, CK2180, SBB048202, STK503902, AKOS005171601, CS-W018492, FA57262, PS-3016, SY010673, DB-022168, A1652, ST50405626, EN300-86148, AE-562/43460672, Z1203161684

3-Acetylbenzoic Acid serves as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals. Its acetyl and carboxylic acid groups enable reactions such as esterification, amidation, and condensation. Researchers utilize it in the development of drug candidates and fine chemicals. It is also employed in material science for polymer modification and as a building block for advanced organic frameworks.

Safety and Hazards

GHS Hazard Statements

  • H315 (88.9%): Causes skin irritation [Warning Skin corrosion/irritation]
  • H319 (88.9%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
  • H335 (77.8%): 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 (88.9%)
  • Eye Irrit. 2A (88.9%)
  • STOT SE 3 (77.8%)

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