Atomfair 2-Phenylnicotinic acid C12H9NO2 CAS 33421-39-5

Description

2-Phenylnicotinic Acid (2-phenylpyridine-3-carboxylic acid) is a high-purity organic compound with the molecular formula C₁₂H₉NO₂ and CAS number 33421-39-5. This heterocyclic carboxylic acid features a phenyl group attached to the 2-position of a nicotinic acid scaffold, making it a valuable intermediate in pharmaceutical and agrochemical research. With a molecular weight of 199.21 g/mol, this white to off-white crystalline powder is ideal for synthetic applications requiring precise structural modification. Our product is rigorously tested for purity (typically ≥95% by HPLC) and is supplied with comprehensive analytical data including ¹H NMR, ¹³C NMR, and mass spectrometry reports. Suitable for use in medicinal chemistry, ligand design, and as a building block for advanced materials, this compound is packaged under inert atmosphere to ensure stability and longevity.

Properties

• CAS Number: 33421-39-5
• Complexity: 224
• IUPAC Name: 2-phenylpyridine-3-carboxylic acid
• InChI: InChI=1S/C12H9NO2/c14-12(15)10-7-4-8-13-11(10)9-5-2-1-3-6-9/h1-8H,(H,14,15)
• InChI Key: VLQVAEFYIADOKI-UHFFFAOYSA-N
• Exact Mass: 199.063328530
• Molecular Formula: C12H9NO2
• Molecular Weight: 199.20
• SMILES: C1=CC=C(C=C1)C2=C(C=CC=N2)C(=O)O
• Topological: 50.2
• Monoisotopic Mass: 199.063328530
• Synonyms: 2-Phenylnicotinic acid, EINECS 251-510-7, DTXSID80187060, NSC 127178, DTXCID90109551, 251-510-7, 33421-39-5, 2-phenylpyridine-3-carboxylic acid, 2-PhenylnicotinicAcid, MFCD03069417, 2-Phenyl-nicotinic acid, 2-Phenyl-3-pyridinecarboxylic acid, 3-Pyridinecarboxylic acid, 2-phenyl-, SCHEMBL912675, CHEMBL5440934, NSC127178, SBB053034, AKOS015891494, NSC-127178, PS-4937, SB52334, SY017179, DB-011087, CS-0060518, NS00029486, P2452, EN300-100753

Application

2-Phenylnicotinic acid serves as a versatile building block in medicinal chemistry, particularly in the synthesis of kinase inhibitors and other bioactive molecules targeting inflammatory pathways. Researchers utilize this compound as a precursor for metal-organic frameworks (MOFs) due to its bifunctional (carboxylate and aromatic) coordination properties. In material science, it finds application in the development of organic semiconductors and liquid crystal displays owing to its conjugated π-system.

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]

Precautionary Statements

• P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364

Hazard Classes and Categories

• Skin Irrit. 2 (100%)
• Eye Irrit. 2 (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.