Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate
TL;DR: Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate (CAS 104793-92-2) is a chemical compound with molecular formula C11H16ClNO6S2 and molecular weight 357.01074 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
ethyl 1-(1,3-dithiol-2-ylidene)piperidin-1-ium-4-carboxylate perchlorate
Also Known As: .trans-4-Chlor-crotonsaeure-aethylester, 1-(1,3-Dithiol-2-ylidene)-4-(ethoxycarbonyl)piperidinium perchlorate, Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate, ethyl 1-(1,3-dithiol-2-ylidene)piperidin-1-ium-4-carboxylate perchlorate, ethyl 1-(1,3-dithiol-2-ylidene)piperidin-1-ium-4-carboxylate,perchlorate
Technical Specifications
| Molecular Formula | C11H16ClNO6S2 |
| Molecular Weight | 357.01074 g/mol |
| XLogP | -3.2011 |
| Topological Polar Surface Area (TPSA) | 154.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 3 |
| Exact Mass | 357.01074 Da |
| Heavy Atoms | 21 |
| Complexity | 415.0 |
| SMILES | CCOC(=O)C1CC[N+](=C2SC=CS2)CC1.[O-]Cl(=O)(=O)=O |
| InChIKey | HNTJBDFPUIPYNA-UHFFFAOYSA-M |
Chemical Property Profile of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate
Property Insights of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate
The XLogP value of -3.2011 indicates that Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 154.0 Ų indicates high polarity, suggesting Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate?
The CAS number of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate is 104793-92-2.
What is the molecular formula of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate?
The molecular formula of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate is C11H16ClNO6S2.
What is the molecular weight of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate?
The molecular weight of Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate is 357.01074 g/mol.
Where can I buy Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate?
You can request a quote for Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate?
Yes, CoreyChem provides custom synthesis services for Piperidinium, 1-(1,3-dithiol-2-ylidene)-4-(ethoxycarbonyl)-, perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.