TL;DR: 1,2-Bis(1,2-dichloroethyl)cyclobutane (CAS 83682-62-6) is a chemical compound with molecular formula C8H12Cl4 and molecular weight 247.96931 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2-bis(1,2-dichloroethyl)cyclobutane
Also Known As: 1,2-BIS(1,2-DICHLOROETHYL)CYCLOBUTANE, J1.596.177E
| Molecular Formula | C8H12Cl4 |
| Molecular Weight | 247.96931 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 4 |
| Exact Mass | 249.96635 Da |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
| SMILES | C1CC(C1C(CCl)Cl)C(CCl)Cl |
| InChIKey | SNUAMVHSMOXCTI-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that 1,2-Bis(1,2-dichloroethyl)cyclobutane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,2-Bis(1,2-dichloroethyl)cyclobutane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2-Bis(1,2-dichloroethyl)cyclobutane has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1,2-Bis(1,2-dichloroethyl)cyclobutane is 83682-62-6.
The molecular formula of 1,2-Bis(1,2-dichloroethyl)cyclobutane is C8H12Cl4.
The molecular weight of 1,2-Bis(1,2-dichloroethyl)cyclobutane is 247.96931 g/mol.
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