TL;DR: 3-Methyl-5-azoniaspiro[4.4]nonane chloride (CAS 1029879-46-6) is a chemical compound with molecular formula C9H18ClN and molecular weight 175.11278 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-methyl-5-azoniaspiro[4.4]nonane chloride
Also Known As: 2-methyl-5-azoniaspiro[4.4]nonane Chloride, 3-methyl-5-azoniaspiro[4.4]nonane;chloride, 8-methyl-5-azoniaspiro[4.4]nonane chloride
| Molecular Formula | C9H18ClN |
| Molecular Weight | 175.11278 g/mol |
| XLogP | -1.3592 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 175.11278 Da |
| Heavy Atoms | 11 |
| Complexity | 125.0 |
| SMILES | CC1CC[N+]2(C1)CCCC2.[Cl-] |
| InChIKey | HGMVKURAVVOTJB-UHFFFAOYSA-M |
The XLogP value of -1.3592 indicates that 3-Methyl-5-azoniaspiro[4.4]nonane chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 0.0 Ų, 3-Methyl-5-azoniaspiro[4.4]nonane chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-5-azoniaspiro[4.4]nonane chloride has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Methyl-5-azoniaspiro[4.4]nonane chloride is 1029879-46-6.
The molecular formula of 3-Methyl-5-azoniaspiro[4.4]nonane chloride is C9H18ClN.
The molecular weight of 3-Methyl-5-azoniaspiro[4.4]nonane chloride is 175.11278 g/mol.
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