TL;DR: Trichloropyrogallol (CAS 56961-21-8) is a chemical compound with molecular formula C6H3Cl3O3 and molecular weight 227.91478 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4,5,6-trichlorobenzene-1,2,3-triol
Also Known As: Trichloropyrogallol, Pyrogallol, trichloro-, 4,5,6-trichlorobenzene-1,2,3-triol, trichlorodi-hydroxy-phenol, trichlorobenzene-1,2,3-triol
| Molecular Formula | C6H3Cl3O3 |
| Molecular Weight | 227.91478 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.91478 Da |
| Heavy Atoms | 12 |
| Complexity | 152.0 |
| SMILES | C1(=C(C(=C(C(=C1O)Cl)Cl)Cl)O)O |
| InChIKey | CJQALGPVJPPULG-UHFFFAOYSA-N |
The XLogP value of 3.3 indicates that Trichloropyrogallol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichloropyrogallol. Following Lipinski's Rule of Five, Trichloropyrogallol has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Trichloropyrogallol is 56961-21-8.
The molecular formula of Trichloropyrogallol is C6H3Cl3O3.
The molecular weight of Trichloropyrogallol is 227.91478 g/mol.
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