TL;DR: 3,4-Dimethoxy-alpha-methylbenzeneethanol (CAS 19578-92-8) is a chemical compound with molecular formula C11H16O3 and molecular weight 196.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dimethoxyphenyl)propan-2-ol
Also Known As: 1-(3,4-dimethoxyphenyl)propan-2-ol, 1-(3,4-Dimethoxyphenyl)-2-propanol, Hex-5-ynoylchloride, (R)-1-(3,4-dimethoxyphenyl)propan-2-ol, 2-Propanol, l-(3,4-dimethoxyphenyl)-
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H16O3 |
| Molecular Weight | 196.10994 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.10994 Da |
| Heavy Atoms | 14 |
| Complexity | 161.0 |
| SMILES | CC(CC1=CC(=C(C=C1)OC)OC)O |
| InChIKey | KWJDGWGMDAQESJ-UHFFFAOYSA-N |
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Dimethoxy-alpha-methylbenzeneethanol. With a topological polar surface area (TPSA) of 38.7 Ų, 3,4-Dimethoxy-alpha-methylbenzeneethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Dimethoxy-alpha-methylbenzeneethanol 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 3,4-Dimethoxy-alpha-methylbenzeneethanol is 19578-92-8.
The molecular formula of 3,4-Dimethoxy-alpha-methylbenzeneethanol is C11H16O3.
The molecular weight of 3,4-Dimethoxy-alpha-methylbenzeneethanol is 196.10994 g/mol.
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