TL;DR: 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin (CAS 50585-43-8) is a chemical compound with molecular formula C12H4Br2F2O2 and molecular weight 375.8546 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-dibromo-7,8-difluorodibenzo-p-dioxin
Also Known As: 2,3-DIBROMO-7,8-DIFLUORODIBENZO-P-DIOXIN, 2,3-dibromo-7,8-difluorooxanthrene, 2,3-Dibrom-7,8-difluordibenzo-p-dioxin, 2,3-dibromo-7,8-difluoro-dibenzo[1,4]dioxine, 2,3-Dibromo-7,8-difluorodibenzo[b,e][1,4]dioxin
| Molecular Formula | C12H4Br2F2O2 |
| Molecular Weight | 375.8546 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 377.85257 Da |
| Heavy Atoms | 18 |
| Complexity | 290.0 |
| SMILES | C1=C2C(=CC(=C1F)F)OC3=CC(=C(C=C3O2)Br)Br |
| InChIKey | OYZFZUIMCOBMIR-UHFFFAOYSA-N |
The XLogP value of 4.6 indicates that 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin is 50585-43-8.
The molecular formula of 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin is C12H4Br2F2O2.
The molecular weight of 2,3-Dibromo-7,8-difluorodibenzo-p-dioxin is 375.8546 g/mol.
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