TL;DR: Methyl trifluoromethyl disulfide (CAS 14410-21-0) is a chemical compound with molecular formula C2H3F3S2 and molecular weight 147.96283 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trifluoro-(methyldisulfanyl)methane
Also Known As: Methyl trifluoromethyl disulfide, methyltrifluoromethyldisulfide, Disulfide, methyl trifluoromethyl, trifluoro-(methyldisulfanyl)methane, TRIFLUORO(METHYLDISULFANYL)METHANE
| Molecular Formula | C2H3F3S2 |
| Molecular Weight | 147.96283 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 50.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 147.96283 Da |
| Heavy Atoms | 7 |
| Complexity | 49.0 |
| SMILES | CSSC(F)(F)F |
| InChIKey | MFDUILJQUNCMBC-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl trifluoromethyl disulfide. With a topological polar surface area (TPSA) of 50.6 Ų, Methyl trifluoromethyl disulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl trifluoromethyl disulfide has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methyl trifluoromethyl disulfide is 14410-21-0.
The molecular formula of Methyl trifluoromethyl disulfide is C2H3F3S2.
The molecular weight of Methyl trifluoromethyl disulfide is 147.96283 g/mol.
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