氟芬那酸
TL;DR: 氟芬那酸 (CAS 530-78-9) is a chemical compound with molecular formula C14H10F3NO2 and molecular weight 281.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氟芬那酸
2-[3-(trifluoromethyl)anilino]benzoic acid
Also Known As: flufenamic acid, Arlef, Achless, Fluphenamic acid, Nichisedan
| Molecular Formula | C14H10F3NO2 |
|---|---|
| Molecular Weight | 281.07 g/mol |
| LogP | 5.2 |
| Topological Polar Surface Area | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.06638 |
| Heavy Atoms | 20 |
| Complexity | 346.0 |
| Melting Point | 133.5 |
| Solubility | 9.09 |
Chemical Identifiers
| CAS Number | 530-78-9 |
|---|---|
| SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F |
| InChIKey | LPEPZBJOKDYZAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氟芬那酸 (CAS 530-78-9), with molecular formula C14H10F3NO2 and molecular weight 281.07 g/mol. IUPAC: 2-[3-(trifluoromethyl)anilino]benzoic acid.
Chemical Property Profile of 氟芬那酸
Property Insights of 氟芬那酸
The XLogP value of 5.2 indicates that 氟芬那酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 49.3 Ų, 氟芬那酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氟芬那酸 has 2 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 氟芬那酸?
The CAS number of 氟芬那酸 is 530-78-9.
What is the molecular formula of 氟芬那酸?
The molecular formula of 氟芬那酸 is C14H10F3NO2.
What is the molecular weight of 氟芬那酸?
The molecular weight of 氟芬那酸 is 281.07 g/mol.
Where can I buy 氟芬那酸?
You can request a quote for 氟芬那酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氟芬那酸?
Yes, KEHONG BIO provides custom synthesis services for 氟芬那酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.