TL;DR: 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene (CAS 131803-37-7) is a chemical compound with molecular formula C8H4Cl2F4 and molecular weight 245.96262 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4-bis(chloromethyl)-2,3,5,6-tetrafluorobenzene
Also Known As: 1,4-Bis(chloromethyl)tetrafluorobenzene, 1,4-bis(chloromethyl)-2,3,5,6-tetrafluorobenzene, 5892AA, J1.853.826A, 1,4-bis(chloromethyl)-2,3,5,6-tetrafluoro-benzene
| Molecular Formula | C8H4Cl2F4 |
| Molecular Weight | 245.96262 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 245.96262 Da |
| Heavy Atoms | 14 |
| Complexity | 156.0 |
| SMILES | C(C1=C(C(=C(C(=C1F)F)CCl)F)F)Cl |
| InChIKey | WEUAASLFNKTIIM-UHFFFAOYSA-N |
The XLogP value of 3.1 indicates that 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene is 131803-37-7.
The molecular formula of 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene is C8H4Cl2F4.
The molecular weight of 1,4-Bis(chloromethyl)-2,3,5,6-tetrafluorobenzene is 245.96262 g/mol.
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