101012-12-8 | 2-Chloro-1,3-thiazole-5-carboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$16.00	$11.00
1g	95%	in stock	$18.00	$12.00
5g	95%	in stock	$33.00	$23.00
100g	95%	in stock	$582.00	$408.00

Description

• Catalog Number: AA04392
• Chemical Name: 2-Chloro-1,3-thiazole-5-carboxylic acid
• CAS Number: 101012-12-8
• Molecular Formula: C4H2ClNO2S
• Molecular Weight: 163.5822
• MDL Number: MFCD02187331
• SMILES: OC(=O)c1cnc(s1)Cl

Computed Properties

• Complexity: 132
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 9
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.8

Upstream Synthesis Route

2-Chloro-1,3-thiazole-5-carboxylic acid is a versatile building block in chemical synthesis, particularly in the field of medicinal chemistry. This compound serves as a key intermediate in the synthesis of various pharmaceutical agents and agrochemicals due to its unique structural features and reactivity. By incorporating 2-Chloro-1,3-thiazole-5-carboxylic acid into synthetic pathways, chemists can introduce the thiazole ring system, which is found in many biologically active compounds. Additionally, the chlorine atom at the 2-position provides a handle for further derivatization, allowing for the introduction of various functional groups to modulate the compound's properties. Overall, the strategic use of 2-Chloro-1,3-thiazole-5-carboxylic acid enables the efficient synthesis of diverse molecules with potential applications in drug discovery and crop protection.

Literature

• Neonicotinoid insecticides: oxidative stress in planta and metallo-oxidase inhibition.

  Journal of agricultural and food chemistry 20110511