Pentolinium
TL;DR: Pentolinium (CAS 144-44-5) is a chemical compound with molecular formula C15H32N2+2 and molecular weight 240.25655 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-1-[5-(1-methylpyrrolidin-1-ium-1-yl)pentyl]pyrrolidin-1-ium
Also Known As: Pentolinium, Pentolonium, Pentolonum, pentolineum, pentolinium ion
Application Areas
Top 5 of 12 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C15H32N2+2 |
| Molecular Weight | 240.25655 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 6 |
| Exact Mass | 240.25655 Da |
| Heavy Atoms | 17 |
| Complexity | 201.0 |
| Melting Point | 213 |
| Solubility | 1.16e-05 g/L |
| SMILES | C[N+]1(CCCC1)CCCCC[N+]2(CCCC2)C |
| InChIKey | XSBSKEQEUFOSDD-UHFFFAOYSA-N |
Product Description
Applications: Pentolinium is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
A pharmaceutical intermediate supplied by CoreyChem, Pentolinium (CAS 144-44-5) has the molecular formula C15H32N2+2 and a molecular weight of 240.26 g/mol. Reported properties include a solubility: 1.16e-05 g/L. Synonyms include Pentolinium and Pentolonium.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Pentolinium
Property Insights of Pentolinium
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentolinium. With a topological polar surface area (TPSA) of 0.0 Ų, Pentolinium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentolinium has 0 hydrogen bond donor(s) and 0 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pentolinium?
The CAS number of Pentolinium is 144-44-5.
What is the molecular formula of Pentolinium?
The molecular formula of Pentolinium is C15H32N2+2.
What is the molecular weight of Pentolinium?
The molecular weight of Pentolinium is 240.25655 g/mol.
What are the applications of Pentolinium?
Pentolinium is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Pentolinium?
You can request a quote for Pentolinium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pentolinium?
Yes, CoreyChem provides custom synthesis services for Pentolinium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.