1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate
TL;DR: 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate (CAS 2581-81-9) is a chemical compound with molecular formula C13H21ClN2O4 and molecular weight 304.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(5-pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate
Also Known As: Pyrrolidinium, 1-(5-pyrrolidino-2,4-pentadienylidene)-, perchlorate, 1-(5-Pyrrolidino-2,4-pentadienylidene)pyrrolidinium perchlorate, Pyrrolidinium, 1-[5-(1-pyrrolidinyl)-2,4-pentadienylidene]-, perchlorate
| Molecular Formula | C13H21ClN2O4 |
|---|---|
| Molecular Weight | 304.12 g/mol |
| LogP | -2.73 |
| Topological Polar Surface Area | 80.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 304.119 |
| Heavy Atoms | 20 |
| Complexity | 332.0 |
Chemical Identifiers
| CAS Number | 2581-81-9 |
|---|---|
| SMILES | C1CCN(C1)C=CC=CC=[N+]2CCCC2.[O-]Cl(=O)(=O)=O |
| InChIKey | IOPYAHCREUTVQD-UHFFFAOYSA-M |
Product Overview
1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate (CAS 2581-81-9), with molecular formula C13H21ClN2O4 and molecular weight 304.12 g/mol. IUPAC: 1-(5-pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate.
Chemical Property Profile of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate
Property Insights of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate
The XLogP value of -2.73 indicates that 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 80.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate. Following Lipinski's Rule of Five, 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate?
The CAS number of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate is 2581-81-9.
What is the molecular formula of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate?
The molecular formula of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate is C13H21ClN2O4.
What is the molecular weight of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate?
The molecular weight of 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate is 304.12 g/mol.
Where can I buy 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate?
You can request a quote for 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate?
Yes, KEHONG BIO provides custom synthesis services for 1-(5-Pyrrolidin-1-ium-1-ylidenepenta-1,3-dienyl)pyrrolidine perchlorate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.