TL;DR: 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- (CAS 117238-43-4) is a chemical compound with molecular formula C17H15ClO2 and molecular weight 286.07605 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-1-(3-methyl-1-benzofuran-2-yl)ethanol
Also Known As: alpha-(4-Chlorophenyl)-alpha,3-dimethyl-2-benzofuranmethanol, 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl-, 1-(4-chlorophenyl)-1-(3-methyl-1-benzofuran-2-yl)ethanol, 1-(4-Chlorophenyl)-1-(3-methyl-1-benzofuran-2-yl)ethan-1-ol
| Molecular Formula | C17H15ClO2 |
| Molecular Weight | 286.07605 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 33.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 286.07605 Da |
| Heavy Atoms | 20 |
| Complexity | 340.0 |
| SMILES | CC1=C(OC2=CC=CC=C12)C(C)(C3=CC=C(C=C3)Cl)O |
| InChIKey | JYOYTMQUCUHFHT-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 33.4 Ų, 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- 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 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- is 117238-43-4.
The molecular formula of 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- is C17H15ClO2.
The molecular weight of 2-Benzofuranmethanol, alpha-(4-chlorophenyl)-alpha,3-dimethyl- is 286.07605 g/mol.
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