![2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate structure](/static/products/3340/3340-19-0.webp)
2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate
TL;DR: 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate (CAS 3340-19-0) is a chemical compound with molecular formula C16H17NO5S and molecular weight 335.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate
Also Known As: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate, 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl], 2-[[6-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-yl]methyl]benzenesulfonate, 2-{[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl}benzene-1-sulfonate
| Molecular Formula | C16H17NO5S |
|---|---|
| Molecular Weight | 335.08 g/mol |
| LogP | 1.146 |
| Topological Polar Surface Area | 79.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 335.08273 |
| Heavy Atoms | 23 |
| Complexity | 812.7252 |
Chemical Identifiers
| CAS Number | 3340-19-0 |
|---|---|
| SMILES | CC1(OCCO1)C2=CC=CC=[N+]2CC3=CC=CC=C3S(=O)(=O)[O-] |
Product Overview
2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate (CAS 3340-19-0), with molecular formula C16H17NO5S and molecular weight 335.08 g/mol. IUPAC: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate.
Chemical Property Profile of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate
Property Insights of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate
The XLogP value of 1.146 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate. The TPSA of 79.54 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate. Following Lipinski's Rule of Five, 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate 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 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate?
The CAS number of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate is 3340-19-0.
What is the molecular formula of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate?
The molecular formula of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate is C16H17NO5S.
What is the molecular weight of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate?
The molecular weight of 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate is 335.08 g/mol.
Where can I buy 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate?
You can request a quote for 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for 2-[[2-(2-Methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.