TL;DR: alpha(or beta)-methyl-1H-imidazole-1-ethanol (CAS 191725-72-1) is a chemical compound with molecular formula C6H10N2O and molecular weight 126.079315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-imidazol-1-ylpropan-1-ol
Also Known As: 2-(1h-imidazol-1-yl)propan-1-ol, 2-imidazol-1-ylpropan-1-ol, Polyethylenepolyamine, 1H-Imidazole-1-ethanol,beta-methyl-(9CI), 2-(1H-IMIDAZOL-1-YL)-1-PROPANOL
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H10N2O |
| Molecular Weight | 126.079315 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 126.079315 Da |
| Heavy Atoms | 9 |
| Complexity | 87.0 |
| SMILES | CC(CO)N1C=CN=C1 |
| InChIKey | ZEMKCDHZMTZUKJ-UHFFFAOYSA-N |
The XLogP value of -0.3 indicates that alpha(or beta)-methyl-1H-imidazole-1-ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 38.1 Ų, alpha(or beta)-methyl-1H-imidazole-1-ethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha(or beta)-methyl-1H-imidazole-1-ethanol has 1 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 alpha(or beta)-methyl-1H-imidazole-1-ethanol is 191725-72-1.
The molecular formula of alpha(or beta)-methyl-1H-imidazole-1-ethanol is C6H10N2O.
The molecular weight of alpha(or beta)-methyl-1H-imidazole-1-ethanol is 126.079315 g/mol.
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