TL;DR: 1,8-Dichlorodibenzofuran (CAS 81638-37-1) is a chemical compound with molecular formula C12H6Cl2O and molecular weight 235.97957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,8-dichlorodibenzofuran
Also Known As: 1,8-DICHLORODIBENZOFURAN, PCDF 10, Dibenzofuran, 1,8-dichloro, 1,8-dichlorodibenzo[b,d]furan, 3,12-dichloro-8-oxatricyclo(7.4.0.02,7)trideca-1(13),2,4,6,9,11-hexaene
| Molecular Formula | C12H6Cl2O |
| Molecular Weight | 235.97957 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 235.97957 Da |
| Heavy Atoms | 15 |
| Complexity | 246.0 |
| SMILES | C1=CC2=C(C(=C1)Cl)C3=C(O2)C=CC(=C3)Cl |
| InChIKey | UAFNQQBPUWFPGC-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 1,8-Dichlorodibenzofuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 1,8-Dichlorodibenzofuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,8-Dichlorodibenzofuran has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,8-Dichlorodibenzofuran is 81638-37-1.
The molecular formula of 1,8-Dichlorodibenzofuran is C12H6Cl2O.
The molecular weight of 1,8-Dichlorodibenzofuran is 235.97957 g/mol.
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