4-fluorobutanoic Acid
TL;DR: 4-fluorobutanoic Acid (CAS 462-23-7) is a chemical compound with molecular formula C4H7FO2 and molecular weight 106.04301 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-fluorobutanoic acid
Also Known As: 4-fluorobutanoic Acid, 4-FLUOROBUTYRIC ACID, 4-Fluorobutyricacid, 4-fluorobutanoicAcid, 4-fluoro-butyric acid
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H7FO2 |
| Molecular Weight | 106.04301 g/mol |
| XLogP | 0.4 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 106.04301 Da |
| Heavy Atoms | 7 |
| Complexity | 62.0 |
| SMILES | C(CC(=O)O)CF |
| InChIKey | BDXSWIQVLYXSSU-UHFFFAOYSA-N |
Product Description
Applications: 4-fluorobutanoic Acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-fluorobutanoic Acid is a heterocyclic building block identified by CAS number 462-23-7 and the molecular formula C4H7FO2 and a molecular weight of 106.04 g/mol. Synonyms include 4-fluorobutanoic Acid and 4-FLUOROBUTYRIC 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 4-fluorobutanoic Acid
Property Insights of 4-fluorobutanoic Acid
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-fluorobutanoic Acid. With a topological polar surface area (TPSA) of 37.3 Ų, 4-fluorobutanoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-fluorobutanoic 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 4-fluorobutanoic Acid?
The CAS number of 4-fluorobutanoic Acid is 462-23-7.
What is the molecular formula of 4-fluorobutanoic Acid?
The molecular formula of 4-fluorobutanoic Acid is C4H7FO2.
What is the molecular weight of 4-fluorobutanoic Acid?
The molecular weight of 4-fluorobutanoic Acid is 106.04301 g/mol.
What are the applications of 4-fluorobutanoic Acid?
4-fluorobutanoic Acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as agrochemical development, including crop protection agent synthesis. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both...
Where can I buy 4-fluorobutanoic Acid?
You can request a quote for 4-fluorobutanoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-fluorobutanoic Acid?
Yes, CoreyChem provides custom synthesis services for 4-fluorobutanoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.