1000339-51-4 | 3-Fluoro-2-nitrobenzoic acid

Packsize	Purity	Availability	Price	Discounted Price
1g	98%	in stock	$19.00	$14.00
5g	98%	in stock	$74.00	$52.00
10g	98%	in stock	$135.00	$95.00
25g	98%	in stock	$198.00	$139.00
100g	98%	in stock	$699.00	$490.00

Description

• Catalog Number: AA00242
• Chemical Name: 3-Fluoro-2-nitrobenzoic acid
• CAS Number: 1000339-51-4
• Molecular Formula: C7H4FNO4
• Molecular Weight: 185.1094
• MDL Number: MFCD07368342
• SMILES: [O-][N+](=O)c1c(F)cccc1C(=O)O

Computed Properties

• Complexity: 227
• Covalently-Bonded Unit Count: 1
• Heavy Atom Count: 13
• Hydrogen Bond Acceptor Count: 5
• Hydrogen Bond Donor Count: 1
• Rotatable Bond Count: 1
• XLogP3: 1.4

Upstream Synthesis Route

3-Fluoro-2-nitrobenzoic acid is a versatile compound widely utilized in chemical synthesis, particularly in the field of organic chemistry. This compound serves as a crucial building block for the preparation of various pharmaceuticals, agrochemicals, and advanced materials. Its unique structure and reactivity make it an indispensable intermediate in the synthesis of complex organic molecules. In particular, 3-Fluoro-2-nitrobenzoic acid is frequently employed in the production of fluorinated aromatic compounds, which are of great interest due to their distinctive properties and potential applications across different industries. Additionally, the presence of both a fluoro and nitro group in its structure offers the opportunity for further functionalization, enabling the creation of diverse chemical entities with tailored properties. Scientists and researchers rely on the strategic incorporation of 3-Fluoro-2-nitrobenzoic acid into synthetic routes to access novel compounds with enhanced biological activities or specific functionalities. Its role in chemical synthesis highlights its significance as a key precursor for the development of innovative molecules with potential implications in various research fields.

Literature

• Head-to-backbone cyclization of peptides on solid support by nucleophilic aromatic substitution.

  The Journal of organic chemistry 20020222