2-Fluorobenzoic acid
TL;DR: 2-Fluorobenzoic acid (CAS 445-29-4) is a chemical compound with molecular formula C7H5FO2 and molecular weight 140.02736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-fluorobenzoic acid
Also Known As: 2-FLUOROBENZOIC ACID, o-Fluorobenzoic acid, Benzoic acid, 2-fluoro-, fluorobenzoic acid, o-Fluorbenzoesaeure
Application Areas
Top 5 of 20 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H5FO2 |
| Molecular Weight | 140.02736 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 140.02736 Da |
| Heavy Atoms | 10 |
| Complexity | 136.0 |
| Vapor Pressure | 0.05 [mmHg] |
| SMILES | C1=CC=C(C(=C1)C(=O)O)F |
| InChIKey | NSTREUWFTAOOKS-UHFFFAOYSA-N |
Product Description
Applications: 2-Fluorobenzoic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Fluorobenzoic acid (CAS 445-29-4) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A heterocyclic building block supplied by CoreyChem, 2-Fluorobenzoic acid (CAS 445-29-4) has the molecular formula C7H5FO2 and a molecular weight of 140.03 g/mol. It is also known as 2-FLUOROBENZOIC ACID and o-Fluorobenzoic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 2-Fluorobenzoic acid
Property Insights of 2-Fluorobenzoic acid
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluorobenzoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Fluorobenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorobenzoic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Fluorobenzoic acid?
The CAS number of 2-Fluorobenzoic acid is 445-29-4.
What is the molecular formula of 2-Fluorobenzoic acid?
The molecular formula of 2-Fluorobenzoic acid is C7H5FO2.
What is the molecular weight of 2-Fluorobenzoic acid?
The molecular weight of 2-Fluorobenzoic acid is 140.02736 g/mol.
What are the applications of 2-Fluorobenzoic acid?
2-Fluorobenzoic acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 2-Fluorobenzoic acid (CAS...
Where can I buy 2-Fluorobenzoic acid?
You can request a quote for 2-Fluorobenzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Fluorobenzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Fluorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.