TL;DR: Tetrabromodichlorodibenzofuran (CAS 107207-44-3) is a chemical compound with molecular formula C12H8Br4Cl2O-6 and molecular weight 553.6686 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dibenzofuran;tetrabromide;dichloride
Also Known As: Tetrabromodichlorodibenzofuran, dibenzofuran;tetrabromide;dichloride, TETRABROMO-DICHLORODIBENZOFURAN, Dibenzofuran, dibromotetrachloro-, Dibenzofuran, tetrabromodichloro-
| Molecular Formula | C12H8Br4Cl2O-6 |
| Molecular Weight | 553.6686 g/mol |
| XLogP | -14.39 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 0 |
| Exact Mass | 553.6686 Da |
| Heavy Atoms | 19 |
| Complexity | 170.0 |
| SMILES | C1=CC=C2C(=C1)C3=CC=CC=C3O2.[Cl-].[Cl-].[Br-].[Br-].[Br-].[Br-] |
| InChIKey | PZZVVTRRABHNGK-UHFFFAOYSA-H |
The XLogP value of -14.39 indicates that Tetrabromodichlorodibenzofuran is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 13.1 Ų, Tetrabromodichlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Tetrabromodichlorodibenzofuran has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Tetrabromodichlorodibenzofuran is 107207-44-3.
The molecular formula of Tetrabromodichlorodibenzofuran is C12H8Br4Cl2O-6.
The molecular weight of Tetrabromodichlorodibenzofuran is 553.6686 g/mol.
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