TL;DR: 3-Amino-2,4,6-tribromophenol (CAS 132331-08-9) is a chemical compound with molecular formula C6H4Br3NO and molecular weight 342.7843 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-2,4,6-tribromophenol
Also Known As: 3-amino-2,4,6-tribromophenol, 2,4,6-Tribromo-3-aminophenol, 2,4,6-tribromo-3-hydroxyaniline, Phenol, 3-amino-2,4,6-tribromo-, J2.091.945K
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H4Br3NO |
| Molecular Weight | 342.7843 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 46.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 342.7843 Da |
| Heavy Atoms | 11 |
| Complexity | 146.0 |
| SMILES | C1=C(C(=C(C(=C1Br)O)Br)N)Br |
| InChIKey | SJWCHTASGVKLLS-UHFFFAOYSA-N |
The XLogP value of 4.0 indicates that 3-Amino-2,4,6-tribromophenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.3 Ų, 3-Amino-2,4,6-tribromophenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Amino-2,4,6-tribromophenol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Amino-2,4,6-tribromophenol is 132331-08-9.
The molecular formula of 3-Amino-2,4,6-tribromophenol is C6H4Br3NO.
The molecular weight of 3-Amino-2,4,6-tribromophenol is 342.7843 g/mol.
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