Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester
TL;DR: Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester (CAS 110029-80-6) is a chemical compound with molecular formula C17H35IN2O2 and molecular weight 426.17432 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 4-methyl-4-nonylpiperazin-4-ium-1-carboxylate iodide
Also Known As: 4-Carboxy-1-methyl-1-nonylpiperazinium iodide ethyl ester, Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester, ethyl 4-methyl-4-nonylpiperazin-4-ium-1-carboxylate iodide, 4-(ETHOXYCARBONYL)-1-METHYL-1-NONYLPIPERAZIN-1-IUM IODIDE
Technical Specifications
| Molecular Formula | C17H35IN2O2 |
| Molecular Weight | 426.17432 g/mol |
| XLogP | 0.6597 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 426.17432 Da |
| Heavy Atoms | 22 |
| Complexity | 287.0 |
| SMILES | CCCCCCCCC[N+]1(CCN(CC1)C(=O)OCC)C.[I-] |
| InChIKey | XTBJGAYATLTZNJ-UHFFFAOYSA-M |
Chemical Property Profile of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester
Property Insights of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester
The XLogP value of 0.6597 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester. With a topological polar surface area (TPSA) of 29.5 Ų, Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester?
The CAS number of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester is 110029-80-6.
What is the molecular formula of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester?
The molecular formula of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester is C17H35IN2O2.
What is the molecular weight of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester?
The molecular weight of Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester is 426.17432 g/mol.
Where can I buy Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester?
You can request a quote for Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester?
Yes, CoreyChem provides custom synthesis services for Piperazinium, 4-carboxy-1-methyl-1-nonyl-, iodide, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.