3-Fluoro-4-n-octyloxybenzoic Acid
TL;DR: 3-Fluoro-4-n-octyloxybenzoic Acid (CAS 2375-76-0) is a chemical compound with molecular formula C15H21FO3 and molecular weight 268.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-fluoro-4-octoxybenzoic acid
Also Known As: 3-Fluoro-4-n-octyloxybenzoic Acid, 3-Fluoro-4-(octyloxy)benzoic acid, 3-fluoro-4-octoxybenzoic acid, 3-fluoro-4-octoxy-benzoic acid, 3-Fluoro-4-(octyloxy)benzoicacid
| Molecular Formula | C15H21FO3 |
|---|---|
| Molecular Weight | 268.15 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 268.14746 |
| Heavy Atoms | 19 |
| Complexity | 258.0 |
Chemical Identifiers
| CAS Number | 2375-76-0 |
|---|---|
| SMILES | CCCCCCCCOC1=C(C=C(C=C1)C(=O)O)F |
| InChIKey | SQVFTDZEUGEJTQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Fluoro-4-n-octyloxybenzoic Acid (CAS 2375-76-0), with molecular formula C15H21FO3 and molecular weight 268.15 g/mol. IUPAC: 3-fluoro-4-octoxybenzoic acid.
Chemical Property Profile of 3-Fluoro-4-n-octyloxybenzoic Acid
Property Insights of 3-Fluoro-4-n-octyloxybenzoic Acid
The XLogP value of 4.9 indicates that 3-Fluoro-4-n-octyloxybenzoic Acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 3-Fluoro-4-n-octyloxybenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Fluoro-4-n-octyloxybenzoic Acid has 1 hydrogen bond donor(s) and 4 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 3-Fluoro-4-n-octyloxybenzoic Acid?
The CAS number of 3-Fluoro-4-n-octyloxybenzoic Acid is 2375-76-0.
What is the molecular formula of 3-Fluoro-4-n-octyloxybenzoic Acid?
The molecular formula of 3-Fluoro-4-n-octyloxybenzoic Acid is C15H21FO3.
What is the molecular weight of 3-Fluoro-4-n-octyloxybenzoic Acid?
The molecular weight of 3-Fluoro-4-n-octyloxybenzoic Acid is 268.15 g/mol.
Where can I buy 3-Fluoro-4-n-octyloxybenzoic Acid?
You can request a quote for 3-Fluoro-4-n-octyloxybenzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Fluoro-4-n-octyloxybenzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Fluoro-4-n-octyloxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.