TL;DR: Methoxymethyl Phenyl Sulfone (CAS 15251-78-2) is a chemical compound with molecular formula C8H10O3S and molecular weight 186.03506 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methoxymethylsulfonylbenzene
Also Known As: Methoxymethyl phenyl sulfone, methoxymethylsulfonylbenzene, Methoxymethylphenylsulfone, ((Methoxymethyl)sulfonyl)benzene, (Methoxymethyl)phenyl sulfone
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C8H10O3S |
| Molecular Weight | 186.03506 g/mol |
| XLogP | 1.1 |
| Topological Polar Surface Area (TPSA) | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 186.03506 Da |
| Heavy Atoms | 12 |
| Complexity | 209.0 |
| SMILES | COCS(=O)(=O)C1=CC=CC=C1 |
| InChIKey | MZIVRTQIEKRAPI-UHFFFAOYSA-N |
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methoxymethyl Phenyl Sulfone. With a topological polar surface area (TPSA) of 51.8 Ų, Methoxymethyl Phenyl Sulfone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methoxymethyl Phenyl Sulfone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methoxymethyl Phenyl Sulfone is 15251-78-2.
The molecular formula of Methoxymethyl Phenyl Sulfone is C8H10O3S.
The molecular weight of Methoxymethyl Phenyl Sulfone is 186.03506 g/mol.
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