Description

2-(4-Hydroxy-3-phenylbenzoyl)benzoic acid (CAS No. 84627-04-3) is a high-purity organic compound with the molecular formula C₂₀H₁₄O₄. This compound, also known as Fendizoic acid, features a biphenyl backbone substituted with a hydroxy group and a benzoylbenzoic acid moiety, making it a valuable intermediate in pharmaceutical and chemical synthesis. Its precise molecular structure ensures consistent reactivity, ideal for research applications requiring controlled functionalization. Available in various quantities, this product is rigorously tested for purity (>98% by HPLC) and stability, meeting the stringent demands of laboratory and industrial use. Suitable for organic synthesis, medicinal chemistry, and material science research.

Properties

• CAS Number: 84627-04-3
• Complexity: 455
• IUPAC Name: 2-(4-hydroxy-3-phenyl-benzoyl)benzoic acid
• InChI: InChI=1S/C20H14O4/c21-18-11-10-14(12-17(18)13-6-2-1-3-7-13)19(22)15-8-4-5-9-16(15)20(23)24/h1-12,21H,(H,23,24)
• InChI Key: PKHPZNKXOBWFCX-UHFFFAOYSA-N
• Exact Mass: 318.08920892
• Molecular Formula: C20H14O4
• Molecular Weight: 318.3
• SMILES: C1=CC=C(C=C1)C2=C(C=CC(=C2)C(=O)C3=CC=CC=C3C(=O)O)O
• Topological: 74.6
• Monoisotopic Mass: 318.08920892
• Synonyms: 2-(4-hydroxy-3-phenylbenzoyl)benzoic acid, 617-597-4, Fendizoic acid, 84627-04-3, 2-(6-Hydroxy-[1,1′-biphenyl]-3-carbonyl)benzoic acid, FENDIZOATE, 2-(6-HYDROXY-BIPHENYL-3-CARBONYL)-BENZOIC ACID, 432106-71-3, Fendizoato, 2-{6-HYDROXY-[1,1′-BIPHENYL]-3-CARBONYL}BENZOIC ACID, Benzoic acid, 2-[(6-hydroxy[1,1′-biphenyl]-3-yl)carbonyl]-, SCHEMBL9455577, CHEMBL2104248, DTXSID20276528, MFCD00866824, AKOS015855850, AC-37175, DB-090874, 2-(4′-hydroxy-3′-phenylbenzoyl)benzoic acid, E85381, EN300-7435037, 2-[(2′-hydroxy-5′-bi-phenylyl)carbonyl]benzoic acid, 2-[(6-Hydroxy-biphenyl-3-yl)carbonyl]-benzoic acid, 2-(6-Hydroxy-[1,1”-biphenyl]-3-carbonyl)benzoicacid, 2-(6-Hydroxy-[1,1′-biphenyl]-3-carbonyl)benzoicacid, Z2681890932, 2-[(6-Hydroxy[1,1′-biphenyl]-3-yl)carbonyl]benzoic Acid; o-[(6-Hydroxy-3-biphenylyl)carbonyl]benzoic Acid; 2-(3′-Phenyl-4′-hydroxybenzoyl)benzoic Acid

Application

2-(4-Hydroxy-3-phenylbenzoyl)benzoic acid is primarily used as a key intermediate in the synthesis of non-steroidal anti-inflammatory drugs (NSAIDs) and other pharmacologically active compounds. Its bifunctional structure allows for further derivatization, enabling the development of novel therapeutic agents. Researchers also employ this compound in material science for designing organic frameworks and polymer precursors. Its stability and reactivity make it suitable for controlled organic transformations in academic and industrial settings.

Safety and Hazards

GHS Hazard Statements

• H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
• H319 (28.6%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
• H412 (85.7%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]

Precautionary Statements

• P264, P264+P265, P270, P273, P280, P301+P317, P305+P351+P338, P330, P337+P317, and P501

Hazard Classes and Categories

• Acute Tox. 4 (100%)
• Eye Irrit. 2A (28.6%)
• Aquatic Chronic 3 (85.7%)

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