1226205-64-6 | 2-(4-methylphenyl)isonicotinic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$330.00	$231.00
5g	98%	in stock	$1,255.00	$879.00

Description

• Catalog Number: AA56252
• Chemical Name: 2-(4-methylphenyl)isonicotinic acid
• CAS Number: 1226205-64-6
• Molecular Formula: C13H11NO2
• Molecular Weight: 213.2319
• MDL Number: MFCD14666476
• SMILES: Cc1ccc(cc1)c1nccc(c1)C(=O)O

Computed Properties

• Complexity: 246
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 16
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 2.7

Upstream Synthesis Route

2-(p-Tolyl)isonicotinic acid, also known as PTINA, is a versatile compound widely used in chemical synthesis. Due to its unique molecular structure, PTINA serves as a valuable building block in the production of pharmaceuticals, agrochemicals, and specialty chemicals. One of the key applications of PTINA in chemical synthesis is its use as a precursor in the preparation of various heterocyclic compounds. By undergoing selective functional group transformations, PTINA can be modified to introduce specific chemical properties required for the desired end product. This compound's flexibility and reactivity make it an important intermediate in the synthesis of diverse organic molecules with potential applications across different industries.