TL;DR: 1,2,4,7-Tetrachlorodibenzofuran (CAS 83719-40-8) is a chemical compound with molecular formula C12H4Cl4O and molecular weight 303.9016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,4,7-tetrachlorodibenzofuran
Also Known As: 1,2,4,7-TETRACHLORODIBENZOFURAN, PCDF 55, Dibenzofuran, 1,2,4,7-tetrachloro, Dibenzofuran, 1,2,4,7-tetrachloro-, 1,2,4,7-TCDF
| Molecular Formula | C12H4Cl4O |
| Molecular Weight | 303.9016 g/mol |
| XLogP | 5.6 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 305.89868 Da |
| Heavy Atoms | 17 |
| Complexity | 300.0 |
| SMILES | C1=CC2=C(C=C1Cl)OC3=C2C(=C(C=C3Cl)Cl)Cl |
| InChIKey | MFURKMJLDQBHRA-UHFFFAOYSA-N |
The XLogP value of 5.6 indicates that 1,2,4,7-Tetrachlorodibenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 1,2,4,7-Tetrachlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,4,7-Tetrachlorodibenzofuran has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,2,4,7-Tetrachlorodibenzofuran is 83719-40-8.
The molecular formula of 1,2,4,7-Tetrachlorodibenzofuran is C12H4Cl4O.
The molecular weight of 1,2,4,7-Tetrachlorodibenzofuran is 303.9016 g/mol.
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