TL;DR: 2,4-Dichlorodiphenyl ether (CAS 51892-26-3) is a chemical compound with molecular formula C12H8Cl2O and molecular weight 237.99522 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,4-dichloro-1-phenoxybenzene
Also Known As: 2,4-Dichlorodiphenyl ether, 2,4-Dichloro-1-phenoxybenzene, o,p-Dichlorodiphenyl oxide, Benzene, 2,4-dichloro-1-phenoxy-, 2,4-Dichlorophenyl phenyl ether
Top 5 of 8 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C12H8Cl2O |
| Molecular Weight | 237.99522 g/mol |
| XLogP | 4.9 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.99522 Da |
| Heavy Atoms | 15 |
| Complexity | 192.0 |
| SMILES | C1=CC=C(C=C1)OC2=C(C=C(C=C2)Cl)Cl |
| InChIKey | KXIPYLZZJZMMPD-UHFFFAOYSA-N |
The XLogP value of 4.9 indicates that 2,4-Dichlorodiphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 2,4-Dichlorodiphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichlorodiphenyl ether 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 2,4-Dichlorodiphenyl ether is 51892-26-3.
The molecular formula of 2,4-Dichlorodiphenyl ether is C12H8Cl2O.
The molecular weight of 2,4-Dichlorodiphenyl ether is 237.99522 g/mol.
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