4056-78-4 | Cyclopentane-1,3-dicarboxylic acid

Packsize	Purity	Availability	Price	Discounted Price
250mg	95%	in stock	$20.00	$14.00
1g	95%	in stock	$25.00	$17.00
5g	95%	in stock	$55.00	$38.00
25g	95%	in stock	$249.00	$175.00
100g	95%	in stock	$867.00	$607.00

Description

• Catalog Number: AD34805
• Chemical Name: Cyclopentane-1,3-dicarboxylic acid
• CAS Number: 4056-78-4
• Molecular Formula: C7H10O4
• Molecular Weight: 158.1519
• MDL Number: MFCD01735467
• SMILES: OC(=O)C1CCC(C1)C(=O)O

Computed Properties

• Complexity: 167
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 11
• Hydrogen Bond Acceptor Count: 4
• Hydrogen Bond Donor Count: 2
• Rotatable Bond Count: 2
• Undefined Atom Stereocenter Count: 2
• XLogP3: 0.1

Upstream Synthesis Route

1,3-Cyclopentanedicarboxylic acid, also known as CPDA, is a versatile compound widely used in chemical synthesis. This organic acid plays a crucial role in the production of various important chemicals and materials. One of its key applications is as a building block in the synthesis of pharmaceuticals and agrochemicals. CPDA serves as a precursor in the construction of complex organic molecules due to its unique structural properties.In chemical synthesis, 1,3-Cyclopentanedicarboxylic acid acts as a starting material for the formation of heterocycles, which are essential components in the design of new drugs and crop protection agents. Its cyclic structure provides opportunities for the creation of diverse molecular architectures through functional group modifications and coupling reactions. By incorporating CPDA into synthetic pathways, chemists can access novel compounds with enhanced biological activities and improved properties.Moreover, 1,3-Cyclopentanedicarboxylic acid exhibits chirality, making it a valuable building block for the preparation of enantiopure compounds. This characteristic enables the synthesis of pharmaceutical intermediates and fine chemicals with high optical purity, which is crucial for bioactivity and selectivity in target molecules. CPDA's flexible nature and reactivity allow for efficient transformations in organic synthesis, facilitating the development of advanced materials and specialized compounds for various industrial applications.

Literature

• Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

  Bioorganic & medicinal chemistry letters 20101101