TL;DR: 2,6-Dibromo-p-toluidine (CAS 6968-24-7) is a chemical compound with molecular formula C7H7Br2N and molecular weight 262.89453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dibromo-4-methylaniline
Also Known As: 2,6-Dibromo-4-methylaniline, 2,6-Dibromo-p-toluidine, 3,5-Dibromo-4-aminotoluene, 2,6-Dibromo-p-toludine, Benzenamine, 2,6-dibromo-4-methyl-
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H7Br2N |
| Molecular Weight | 262.89453 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 264.89246 Da |
| Heavy Atoms | 10 |
| Complexity | 106.0 |
| SMILES | CC1=CC(=C(C(=C1)Br)N)Br |
| InChIKey | ATDIROHVRVQMRO-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that 2,6-Dibromo-p-toluidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.0 Ų, 2,6-Dibromo-p-toluidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dibromo-p-toluidine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,6-Dibromo-p-toluidine is 6968-24-7.
The molecular formula of 2,6-Dibromo-p-toluidine is C7H7Br2N.
The molecular weight of 2,6-Dibromo-p-toluidine is 262.89453 g/mol.
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