Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)
TL;DR: Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) (CAS 68797-53-5) is a chemical compound with molecular formula C14H16Cl2N2 and molecular weight 282.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-pyridin-1-ium-1-ylbut-2-enyl)pyridin-1-ium dichloride
Also Known As: 1,4-Bispyridinium-2-butene, dichloride, Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, dichloride, Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2), 1,1'-(But-2-ene-1,4-diyl)di(pyridin-1-ium) dichloride, RefChem:177613
| Molecular Formula | C14H16Cl2N2 |
|---|---|
| Molecular Weight | 282.07 g/mol |
| LogP | -4.47 |
| Topological Polar Surface Area | 7.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 282.06906 |
| Heavy Atoms | 18 |
| Complexity | 179.0 |
Chemical Identifiers
| CAS Number | 68797-53-5 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)CC=CC[N+]2=CC=CC=C2.[Cl-].[Cl-] |
| InChIKey | ZUJKKBGPKNBRTI-UHFFFAOYSA-L |
Product Overview
Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) (CAS 68797-53-5), with molecular formula C14H16Cl2N2 and molecular weight 282.07 g/mol. IUPAC: 1-(4-pyridin-1-ium-1-ylbut-2-enyl)pyridin-1-ium dichloride.
Chemical Property Profile of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)
Property Insights of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)
The XLogP value of -4.47 indicates that Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 7.8 Ų, Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) has 0 hydrogen bond donor(s) and 2 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 Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)?
The CAS number of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) is 68797-53-5.
What is the molecular formula of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)?
The molecular formula of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) is C14H16Cl2N2.
What is the molecular weight of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)?
The molecular weight of Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) is 282.07 g/mol.
Where can I buy Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)?
You can request a quote for Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2)?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 1,1'-(2-butene-1,4-diyl)bis-, chloride (1:2) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.