TL;DR: Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate (CAS 5888-39-1) is a chemical compound with molecular formula C11H16O4 and molecular weight 212.10486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-acetyloxy-2-bicyclo[2.2.1]heptanyl) acetate
Also Known As: 2,5-Norbornanediol, diacetate, 2,5-Norbornanediol, 2,5-Norbornanediol diacetate, 2,5-Norbornanedioldiacetate, Bicyclo(2.2.1)heptane-2,5-diol, diacetate
| Molecular Formula | C11H16O4 |
| Molecular Weight | 212.10486 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.10486 Da |
| Heavy Atoms | 15 |
| Complexity | 258.0 |
| SMILES | CC(=O)OC1CC2CC1CC2OC(=O)C |
| InChIKey | UFWLNVAHXNWALF-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate. With a topological polar surface area (TPSA) of 52.6 Ų, Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate has 0 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 Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate is 5888-39-1.
The molecular formula of Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate is C11H16O4.
The molecular weight of Bicyclo[2.2.1]heptane-2,5-diol, 2,5-diacetate is 212.10486 g/mol.
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