TL;DR: Bicyclo(2.2.1)heptane-2,2-dimethanol (CAS 15449-66-8) is a chemical compound with molecular formula C9H16O2 and molecular weight 156.11504 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(hydroxymethyl)-2-bicyclo[2.2.1]heptanyl]methanol
Also Known As: bicyclo[2.2.1]heptane-2,2-diyldimethanol, bicyclo[2.2.1]heptane-2,2-dimethanol, 2,2-norbornanedimethanol, Zinc tetraamine fluoborate, 2,2-di-hydroxymethyl-norbornane
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H16O2 |
| Molecular Weight | 156.11504 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.11504 Da |
| Heavy Atoms | 11 |
| Complexity | 152.0 |
| SMILES | C1CC2CC1CC2(CO)CO |
| InChIKey | RGXKKPWZFFCHNE-UHFFFAOYSA-N |
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo(2.2.1)heptane-2,2-dimethanol. With a topological polar surface area (TPSA) of 40.5 Ų, Bicyclo(2.2.1)heptane-2,2-dimethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo(2.2.1)heptane-2,2-dimethanol has 2 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 Bicyclo(2.2.1)heptane-2,2-dimethanol is 15449-66-8.
The molecular formula of Bicyclo(2.2.1)heptane-2,2-dimethanol is C9H16O2.
The molecular weight of Bicyclo(2.2.1)heptane-2,2-dimethanol is 156.11504 g/mol.
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