![Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate structure](/static/products/2765/2765-91-5.webp)
Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate
TL;DR: Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate (CAS 2765-91-5) is a chemical compound with molecular formula C15H12F3NO2 and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(trifluoromethyl)anilino]benzoate
Also Known As: Flufenamic acid, methyl ester, Flufenamic Acid Methyl Ester, methyl 2-[3-(trifluoromethyl)anilino]benzoate, Flufenamic acid, methyl deriv., Benzoic acid, 2-((3-(trifluoromethyl)phenyl)amino)-, methyl ester
| Molecular Formula | C15H12F3NO2 |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 295.082 |
| Heavy Atoms | 21 |
| Complexity | 359.0 |
Chemical Identifiers
| CAS Number | 2765-91-5 |
|---|---|
| SMILES | COC(=O)C1=CC=CC=C1NC2=CC=CC(=C2)C(F)(F)F |
| InChIKey | CACWGKXXWFHZRW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate (CAS 2765-91-5), with molecular formula C15H12F3NO2 and molecular weight 295.08 g/mol. IUPAC: methyl 2-[3-(trifluoromethyl)anilino]benzoate.
Chemical Property Profile of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate
Property Insights of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate
The XLogP value of 5.6 indicates that Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.3 Ų, Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate?
The CAS number of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate is 2765-91-5.
What is the molecular formula of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate?
The molecular formula of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate is C15H12F3NO2.
What is the molecular weight of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate?
The molecular weight of Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate is 295.08 g/mol.
Where can I buy Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate?
You can request a quote for Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[[3-(trifluoromethyl)phenyl]amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.