TL;DR: 2-Bromo-4,6-difluoroaniline hydrobromide (CAS 101471-20-9) is a chemical compound with molecular formula C6H5Br2F2N and molecular weight 286.87567 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bromo-4,6-difluoroaniline;hydrobromide
Also Known As: 2-bromo-4,6-difluoroaniline hydrobromide, 2-bromo-4,6-difluoroaniline;hydrobromide, 2-bromo-4,6-difluoroaniline HBr, 2-Bromo-4,6-difluoroaniline hydrobromide, tech., 2-Bromo-4,6-difluoroanilinehydrobromide
| Molecular Formula | C6H5Br2F2N |
| Molecular Weight | 286.87567 g/mol |
| XLogP | 2.8874 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 286.87567 Da |
| Heavy Atoms | 11 |
| Complexity | 122.0 |
| SMILES | C1=C(C=C(C(=C1F)N)Br)F.Br |
| InChIKey | OYZFQVSHRSBJIJ-UHFFFAOYSA-N |
The XLogP value of 2.8874 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Bromo-4,6-difluoroaniline hydrobromide. With a topological polar surface area (TPSA) of 26.0 Ų, 2-Bromo-4,6-difluoroaniline hydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Bromo-4,6-difluoroaniline hydrobromide has 2 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 2-Bromo-4,6-difluoroaniline hydrobromide is 101471-20-9.
The molecular formula of 2-Bromo-4,6-difluoroaniline hydrobromide is C6H5Br2F2N.
The molecular weight of 2-Bromo-4,6-difluoroaniline hydrobromide is 286.87567 g/mol.
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