2-Fluoro-4-hexyloxybenzoic acid
TL;DR: 2-Fluoro-4-hexyloxybenzoic acid (CAS 128895-75-0) is a chemical compound with molecular formula C13H17FO3 and molecular weight 240.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-fluoro-4-hexoxybenzoic acid
Also Known As: 2-Fluoro-4-hexyloxybenzoic acid, 2-fluoro-4-hexoxybenzoic acid, 2-Fluoro-4-n-hexyloxybenzoic acid, 2-fluoro-4-(hexyloxy)benzoic acid, 2-fluoro-4-hexoxy-benzoic Acid
| Molecular Formula | C13H17FO3 |
|---|---|
| Molecular Weight | 240.12 g/mol |
| LogP | 3.483 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 240.11617 |
| Heavy Atoms | 17 |
| Complexity | 376.92737 |
Chemical Identifiers
| CAS Number | 128895-75-0 |
|---|---|
| SMILES | CCCCCCOC1=CC(=C(C=C1)C(=O)O)F |
Product Overview
2-Fluoro-4-hexyloxybenzoic acid (CAS 128895-75-0), with molecular formula C13H17FO3 and molecular weight 240.12 g/mol. IUPAC: 2-fluoro-4-hexoxybenzoic acid.
Chemical Property Profile of 2-Fluoro-4-hexyloxybenzoic acid
Property Insights of 2-Fluoro-4-hexyloxybenzoic acid
The XLogP value of 3.483 indicates that 2-Fluoro-4-hexyloxybenzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.53 Ų, 2-Fluoro-4-hexyloxybenzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluoro-4-hexyloxybenzoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-Fluoro-4-hexyloxybenzoic acid?
The CAS number of 2-Fluoro-4-hexyloxybenzoic acid is 128895-75-0.
What is the molecular formula of 2-Fluoro-4-hexyloxybenzoic acid?
The molecular formula of 2-Fluoro-4-hexyloxybenzoic acid is C13H17FO3.
What is the molecular weight of 2-Fluoro-4-hexyloxybenzoic acid?
The molecular weight of 2-Fluoro-4-hexyloxybenzoic acid is 240.12 g/mol.
Where can I buy 2-Fluoro-4-hexyloxybenzoic acid?
You can request a quote for 2-Fluoro-4-hexyloxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Fluoro-4-hexyloxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Fluoro-4-hexyloxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.