TL;DR: 1-(5-Methoxy-2-nitrophenyl)ethanol (CAS 156785-62-5) is a chemical compound with molecular formula C9H11NO4 and molecular weight 197.0688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(5-methoxy-2-nitrophenyl)ethanol
Also Known As: 1-(5-Methoxy-2-nitrophenyl)ethanol, 1-(5-methoxy-2-nitrophenyl)ethan-1-ol, 1-(5-Methoxy-2-nitrophenyl)ethanol #, Benzyl alcohol, 5-methoxy-.alpha.-methyl-2-nitro-
| Molecular Formula | C9H11NO4 |
| Molecular Weight | 197.0688 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 75.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 197.0688 Da |
| Heavy Atoms | 14 |
| Complexity | 203.0 |
| SMILES | CC(C1=C(C=CC(=C1)OC)[N+](=O)[O-])O |
| InChIKey | JPQNCBAPUORBRU-UHFFFAOYSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(5-Methoxy-2-nitrophenyl)ethanol. The TPSA of 75.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Methoxy-2-nitrophenyl)ethanol. Following Lipinski's Rule of Five, 1-(5-Methoxy-2-nitrophenyl)ethanol has 1 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-(5-Methoxy-2-nitrophenyl)ethanol is 156785-62-5.
The molecular formula of 1-(5-Methoxy-2-nitrophenyl)ethanol is C9H11NO4.
The molecular weight of 1-(5-Methoxy-2-nitrophenyl)ethanol is 197.0688 g/mol.
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