TL;DR: 1-Methoxypropan-2-yl methanesulfonate (CAS 24590-51-0) is a chemical compound with molecular formula C5H12O4S and molecular weight 168.04562 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxypropan-2-yl methanesulfonate
Also Known As: 1-methoxypropan-2-yl methanesulfonate, 1-Methoxy-2-propanol methanesulfonate, 2-Propanol, methanesulfonate, 1-methoxy-2-propyl methanesulfonate, 1-methoxypropan-2-ylmethanesulfonate
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C5H12O4S |
| Molecular Weight | 168.04562 g/mol |
| XLogP | -0.1 |
| Topological Polar Surface Area (TPSA) | 61.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.04562 Da |
| Heavy Atoms | 10 |
| Complexity | 167.0 |
| SMILES | CC(COC)OS(=O)(=O)C |
| InChIKey | OFLUAKABUQZNOY-UHFFFAOYSA-N |
The XLogP value of -0.1 indicates that 1-Methoxypropan-2-yl methanesulfonate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 61.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methoxypropan-2-yl methanesulfonate. Following Lipinski's Rule of Five, 1-Methoxypropan-2-yl methanesulfonate 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-Methoxypropan-2-yl methanesulfonate is 24590-51-0.
The molecular formula of 1-Methoxypropan-2-yl methanesulfonate is C5H12O4S.
The molecular weight of 1-Methoxypropan-2-yl methanesulfonate is 168.04562 g/mol.
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