116934-87-3 | 4-(Methoxycarbonyl)-3-methylbenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
50mg	95%	in stock	$43.00	$30.00
100mg	95%	in stock	$65.00	$45.00
250mg	95%	in stock	$79.00	$55.00
1g	95%	in stock	$210.00	$147.00

Description

• Catalog Number: AA17170
• Chemical Name: 4-(Methoxycarbonyl)-3-methylbenzoic acid
• CAS Number: 116934-87-3
• Molecular Formula: C10H10O4
• Molecular Weight: 194.184
• MDL Number: MFCD17676540
• SMILES: COC(=O)c1ccc(cc1C)C(=O)O

Computed Properties

• Complexity: 236
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 14
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 3
• XLogP3: 1.7

Upstream Synthesis Route

4-(Methoxycarbonyl)-3-methylbenzoic acid, also known as methyl 3-methyl-4-carboxybenzoate, is a versatile compound widely utilized in chemical synthesis. Its primary application lies in its role as a key building block in the synthesis of various organic molecules and pharmaceutical intermediates. This compound serves as a valuable starting material for the preparation of esters, amides, and other derivatives through traditional organic reactions such as esterification, amidation, and nucleophilic substitution. Its unique structural features make it an essential component in the creation of complex organic structures with enhanced properties.Furthermore, 4-(Methoxycarbonyl)-3-methylbenzoic acid has found prominence in the pharmaceutical industry, where its derivatives exhibit promising biological activities. By incorporating this compound into the chemical synthesis of drug candidates, researchers can explore new avenues for developing novel therapeutic agents with potential applications in medicine.Overall, the versatility and reactivity of 4-(Methoxycarbonyl)-3-methylbenzoic acid make it a valuable tool in chemical synthesis for creating diverse organic compounds and advancing scientific research across various fields.