TL;DR: 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- (CAS 63917-46-4) is a chemical compound with molecular formula C9H16O3 and molecular weight 172.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(9-methyl-1,4-dioxaspiro[4.4]nonan-3-yl)methanol
Also Known As: 6-Methyl-1,4-dioxaspiro(4.4)nonane-2-methanol, 6-Methyl-1,4-dioxaspiro[4.4]nonane-2-methanol, 4-19-00-00697 (Beilstein Handbook Reference), 1,4-DIOXASPIRO(4.4)NONANE-2-METHANOL, 6-METHYL-, (6-methyl-1,4-dioxaspiro[4.4]nonan-2-yl)methanol
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H16O3 |
| Molecular Weight | 172.10994 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 172.10994 Da |
| Heavy Atoms | 12 |
| Complexity | 171.0 |
| SMILES | CC1CCCC12OCC(O2)CO |
| InChIKey | SKUIGVFPSLMMNN-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl-. With a topological polar surface area (TPSA) of 38.7 Ų, 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- 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 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- is 63917-46-4.
The molecular formula of 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- is C9H16O3.
The molecular weight of 1,4-Dioxaspiro(4.4)nonane-2-methanol, 6-methyl- is 172.10994 g/mol.
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