TL;DR: Disulfide, phenyl trichloromethyl (CAS 52739-92-1) is a chemical compound with molecular formula C7H5Cl3S2 and molecular weight 257.88983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(trichloromethyldisulfanyl)benzene
Also Known As: Phenyl trichloromethyl disulfide, DISULFIDE, PHENYL TRICHLOROMETHYL, (trichloromethyldisulfanyl)benzene, [(trichloromethyl)disulfanyl]benzene, Phenyl(trichloromethyl) persulfide
| Molecular Formula | C7H5Cl3S2 |
| Molecular Weight | 257.88983 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 257.88983 Da |
| Heavy Atoms | 12 |
| Complexity | 129.0 |
| SMILES | C1=CC=C(C=C1)SSC(Cl)(Cl)Cl |
| InChIKey | WNSZVZLYZSHDGM-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that Disulfide, phenyl trichloromethyl is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.6 Ų, Disulfide, phenyl trichloromethyl exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Disulfide, phenyl trichloromethyl has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Disulfide, phenyl trichloromethyl is 52739-92-1.
The molecular formula of Disulfide, phenyl trichloromethyl is C7H5Cl3S2.
The molecular weight of Disulfide, phenyl trichloromethyl is 257.88983 g/mol.
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