TL;DR: 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane (CAS 57090-94-5) is a chemical compound with molecular formula C14H22O2 and molecular weight 222.16199 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-(cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane
Also Known As: 6-1,4-dioxaspiro[4.5]decane, 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro(4.5)decane, 6- -1,4-dioxaspiro[4.5]decane, 6-(1-cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane, 6-Cyclohexen-1-yl-1,4-dioxaspiro[4.5]decane
| Molecular Formula | C14H22O2 |
| Molecular Weight | 222.16199 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 222.16199 Da |
| Heavy Atoms | 16 |
| Complexity | 276.0 |
| SMILES | C1CCC(=CC1)C2CCCCC23OCCO3 |
| InChIKey | DWOHCTQVVVIMLI-UHFFFAOYSA-N |
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane. With a topological polar surface area (TPSA) of 18.5 Ų, 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane has 0 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 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane is 57090-94-5.
The molecular formula of 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane is C14H22O2.
The molecular weight of 6-(1-Cyclohexen-1-yl)-1,4-dioxaspiro[4.5]decane is 222.16199 g/mol.
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