TL;DR: Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- (CAS 100199-60-8) is a chemical compound with molecular formula C12H14N2O2 and molecular weight 218.10553 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-(2-imidazol-1-ylethoxy)phenyl]methanol
Also Known As: MR 948, {4-[2-(1H-imidazol-1-yl)ethoxy]phenyl}methanol, Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)-, [4-(2-imidazol-1-ylethoxy)phenyl]methanol, N-(2-(p-Hydroxymethylphenoxy)ethyl)imidazole
| Molecular Formula | C12H14N2O2 |
| Molecular Weight | 218.10553 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 47.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 218.10553 Da |
| Heavy Atoms | 16 |
| Complexity | 193.0 |
| SMILES | C1=CC(=CC=C1CO)OCCN2C=CN=C2 |
| InChIKey | GDNYXDJGFLTMJN-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)-. With a topological polar surface area (TPSA) of 47.3 Ų, Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- has 1 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 Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- is 100199-60-8.
The molecular formula of Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- is C12H14N2O2.
The molecular weight of Benzenemethanol, 4-(2-(1H-imidazol-1-yl)ethoxy)- is 218.10553 g/mol.
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