![3-[4-(trifluoromethyl)phenoxy]benzoic Acid structure](/static/products/7217/72178-29-1.webp)
3-[4-(trifluoromethyl)phenoxy]benzoic Acid
TL;DR: 3-[4-(trifluoromethyl)phenoxy]benzoic Acid (CAS 72178-29-1) is a chemical compound with molecular formula C14H9F3O3 and molecular weight 282.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(trifluoromethyl)phenoxy]benzoic acid
Also Known As: 3-[4-(trifluoromethyl)phenoxy]benzoic Acid, 3-(4-(trifluoromethyl)phenoxy)benzoic acid, Benzoic acid, 3-[4-(trifluoromethyl)phenoxy]-, 3PBD-Q07-0, 3-(4-Trifluoromethylphenoxy)benzoic acid
| Molecular Formula | C14H9F3O3 |
|---|---|
| Molecular Weight | 282.05 g/mol |
| LogP | 4.1959 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 282.05038 |
| Heavy Atoms | 20 |
| Complexity | 618.3064 |
Chemical Identifiers
| CAS Number | 72178-29-1 |
|---|---|
| SMILES | C1=CC(=CC(=C1)OC2=CC=C(C=C2)C(F)(F)F)C(=O)O |
Product Overview
3-[4-(trifluoromethyl)phenoxy]benzoic Acid (CAS 72178-29-1), with molecular formula C14H9F3O3 and molecular weight 282.05 g/mol. IUPAC: 3-[4-(trifluoromethyl)phenoxy]benzoic acid.
Chemical Property Profile of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid
Property Insights of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid
The XLogP value of 4.1959 indicates that 3-[4-(trifluoromethyl)phenoxy]benzoic 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, 3-[4-(trifluoromethyl)phenoxy]benzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[4-(trifluoromethyl)phenoxy]benzoic 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 3-[4-(trifluoromethyl)phenoxy]benzoic Acid?
The CAS number of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid is 72178-29-1.
What is the molecular formula of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid?
The molecular formula of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid is C14H9F3O3.
What is the molecular weight of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid?
The molecular weight of 3-[4-(trifluoromethyl)phenoxy]benzoic Acid is 282.05 g/mol.
Where can I buy 3-[4-(trifluoromethyl)phenoxy]benzoic Acid?
You can request a quote for 3-[4-(trifluoromethyl)phenoxy]benzoic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[4-(trifluoromethyl)phenoxy]benzoic Acid?
Yes, KEHONG BIO provides custom synthesis services for 3-[4-(trifluoromethyl)phenoxy]benzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.