1126-46-1 | Methyl 4-chlorobenzoate

Packsize	Purity	Availability	Price	Discounted Price
25g	98%	in stock	$8.00	$6.00
100g	98%	in stock	$30.00	$21.00

Description

• Catalog Number: AB44949
• Chemical Name: Methyl 4-chlorobenzoate
• CAS Number: 1126-46-1
• Molecular Formula: C8H7ClO2
• Molecular Weight: 170.593
• MDL Number: MFCD00000621
• SMILES: COC(=O)c1ccc(cc1)Cl
• NSC Number: 8366

Computed Properties

• Complexity: 139
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• XLogP3: 2.8

Upstream Synthesis Route

4-Chlorobenzoic Acid Methyl Ester, also known as methyl 4-chlorobenzoate, is a versatile compound commonly used in chemical synthesis. In organic chemistry, it serves as a key building block for the synthesis of various pharmaceuticals, agrochemicals, and fine chemicals. This compound is particularly valuable in the pharmaceutical industry, where it is employed in the production of analgesics, antipyretics, and anti-inflammatory drugs. Its chemical structure allows for functional group transformations, enabling the creation of diverse molecular structures with specific biological activities.Furthermore, 4-Chlorobenzoic Acid Methyl Ester finds application in the synthesis of herbicides and pesticides, where its reactivity and compatibility with other reagents facilitate the efficient production of plant protection products. Its ability to undergo various chemical reactions, such as esterification, makes it a crucial intermediate in the preparation of these agricultural chemicals.In summary, the strategic role of 4-Chlorobenzoic Acid Methyl Ester in chemical synthesis lies in its utility as a versatile and manipulable building block for the creation of valuable molecules in pharmaceuticals, agrochemicals, and other fine chemical applications.

Literature

• Identification of inhibitors of the Leishmania cdc2-related protein kinase CRK3.

  ChemMedChem 20111209