2-Fluorohexanoic acid
TL;DR: 2-Fluorohexanoic acid (CAS 1578-57-0) is a chemical compound with molecular formula C6H11FO2 and molecular weight 134.07431 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-fluorohexanoic acid
Also Known As: 2-Fluorohexanoic acid, Hexanoic acid, 2-fluoro-, fluorohexanoic acid, 2-Fluorohexanoicacid, 2-Fluorocaproic acid
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H11FO2 |
| Molecular Weight | 134.07431 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 134.07431 Da |
| Heavy Atoms | 9 |
| Complexity | 93.0 |
| SMILES | CCCCC(C(=O)O)F |
| InChIKey | CDWPBSAPAJJTHA-UHFFFAOYSA-N |
Chemical Property Profile of 2-Fluorohexanoic acid
Property Insights of 2-Fluorohexanoic acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluorohexanoic acid. With a topological polar surface area (TPSA) of 37.3 Ų, 2-Fluorohexanoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorohexanoic 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-Fluorohexanoic acid?
The CAS number of 2-Fluorohexanoic acid is 1578-57-0.
What is the molecular formula of 2-Fluorohexanoic acid?
The molecular formula of 2-Fluorohexanoic acid is C6H11FO2.
What is the molecular weight of 2-Fluorohexanoic acid?
The molecular weight of 2-Fluorohexanoic acid is 134.07431 g/mol.
Where can I buy 2-Fluorohexanoic acid?
You can request a quote for 2-Fluorohexanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Fluorohexanoic acid?
Yes, CoreyChem provides custom synthesis services for 2-Fluorohexanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.