TL;DR: Acifluorfen (CAS 50594-66-6) is a chemical compound with molecular formula C14H7ClF3NO5 and molecular weight 360.9965 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid
Also Known As: Acifluorfen, Acifluorfene, Acifluorofen, Tackle, Blazer
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C14H7ClF3NO5 |
| Molecular Weight | 360.9965 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 92.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 360.9965 Da |
| Heavy Atoms | 24 |
| Complexity | 484.0 |
| Melting Point | 240 °C |
| Solubility | 0.12 mg/mL at 25 °C |
| SMILES | C1=CC(=C(C=C1C(F)(F)F)Cl)OC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O |
| InChIKey | NUFNQYOELLVIPL-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that Acifluorfen is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Acifluorfen. Following Lipinski's Rule of Five, Acifluorfen has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Acifluorfen is 50594-66-6.
The molecular formula of Acifluorfen is C14H7ClF3NO5.
The molecular weight of Acifluorfen is 360.9965 g/mol.
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