TL;DR: Oxanthrene, 1-bromo-2,3-dichloro- (CAS 131167-09-4) is a chemical compound with molecular formula C12H5BrCl2O2 and molecular weight 329.885 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-bromo-2,3-dichlorodibenzo-p-dioxin
Also Known As: Oxanthrene, 1-bromo-2,3-dichloro-, 1-Bromo-2,3-dichlorooxanthrene, 1-bromo-2,3-dichlorodibenzo-p-dioxin
| Molecular Formula | C12H5BrCl2O2 |
| Molecular Weight | 329.885 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 329.885 Da |
| Heavy Atoms | 17 |
| Complexity | 292.0 |
| SMILES | C1=CC=C2C(=C1)OC3=CC(=C(C(=C3O2)Br)Cl)Cl |
| InChIKey | VTPKTQCOTCSABN-UHFFFAOYSA-N |
The XLogP value of 5.4 indicates that Oxanthrene, 1-bromo-2,3-dichloro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 18.5 Ų, Oxanthrene, 1-bromo-2,3-dichloro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Oxanthrene, 1-bromo-2,3-dichloro- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Oxanthrene, 1-bromo-2,3-dichloro- is 131167-09-4.
The molecular formula of Oxanthrene, 1-bromo-2,3-dichloro- is C12H5BrCl2O2.
The molecular weight of Oxanthrene, 1-bromo-2,3-dichloro- is 329.885 g/mol.
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