52727-57-8 | Methyl 2-amino-5-bromobenzoate

Packsize	Purity	Availability	Price	Discounted Price
10g	95%	in stock	$13.00	$9.00
25g	95%	in stock	$21.00	$15.00
100g	95%	in stock	$56.00	$39.00
500g	95%	in stock	$278.00	$194.00

Description

• Catalog Number: AG24183
• Chemical Name: Methyl 2-amino-5-bromobenzoate
• CAS Number: 52727-57-8
• Molecular Formula: C8H8BrNO2
• Molecular Weight: 230.0586
• MDL Number: MFCD01676902
• SMILES: COC(=O)c1cc(Br)ccc1N

Computed Properties

• Complexity: 174
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 12
• Hydrogen Bond Acceptor Count: 3
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 2
• XLogP3: 3.4

Upstream Synthesis Route

Methyl 2-amino-5-bromobenzoate, also known as ethyl 2-amino-5-bromobenzoate, is a versatile compound widely used in chemical synthesis. This compound serves as a key building block in the synthesis of various pharmaceuticals, agrochemicals, and other organic compounds. Its unique structure and properties make it a valuable intermediate in the production of complex molecules.In chemical synthesis, Methyl 2-amino-5-bromobenzoate can be utilized as a precursor for the generation of diverse nitrogen-containing heterocycles. These heterocycles play a crucial role in the development of new drugs, herbicides, and insecticides. Additionally, this compound can be employed in the construction of functionalized aromatic compounds through various synthetic routes, such as Friedel-Crafts acylation and Suzuki coupling reactions.Furthermore, Methyl 2-amino-5-bromobenzoate is a valuable reagent in the preparation of ligands for catalytic processes, coordination complexes, and chiral auxiliaries. Its presence in the molecular structure imparts specific properties to the resulting compounds, enhancing their performance in various chemical transformations.Overall, Methyl 2-amino-5-bromobenzoate is a versatile and essential compound in chemical synthesis, playing a significant role in the creation of diverse organic molecules with potential applications in the pharmaceutical, agricultural, and industrial sectors.

Literature

• Growth and characterization of Methyl 2-amino-5-bromobenzoate crystal for NLO applications.

  Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20121101

• Methyl 2-amino-5-bromo-benzoate.

  Acta crystallographica. Section E, Structure reports online 20110801

• 6-Bromo-1-methyl-1H-2,1-benzothia-zin-4(3H)-one 2,2-dioxide.

  Acta crystallographica. Section E, Structure reports online 20090501

• Methyl 5-bromo-2-[meth-yl(methyl-sulfon-yl)amino]benzoate.

  Acta crystallographica. Section E, Structure reports online 20090501

• 6-Bromo-1-ethyl-1H-2,1-benzothia-zin-4(3H)-one 2,2-dioxide.

  Acta crystallographica. Section E, Structure reports online 20090201