Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)
TL;DR: Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) (CAS 68516-69-8) is a chemical compound with molecular formula C14H19NO5S and molecular weight 313.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-ethoxy-1,2-dimethylquinolin-1-ium;methyl sulfate
Also Known As: 1,2-Dimethyl-6-ethoxyquinolinium methyl sulfate, Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate, N-Methyl-2-methyl-6-ethoxyquinolinium, methyl sulfate, Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1), 6-Ethoxy-1,2-dimethylquinolin-1-ium methyl sulfate
| Molecular Formula | C14H19NO5S |
|---|---|
| Molecular Weight | 313.10 g/mol |
| LogP | 1.46 |
| Topological Polar Surface Area | 87.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 313.0984 |
| Heavy Atoms | 21 |
| Complexity | 297.0 |
Chemical Identifiers
| CAS Number | 68516-69-8 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)[N+](=C(C=C2)C)C.COS(=O)(=O)[O-] |
| InChIKey | JIDLSBRLRJKSPQ-UHFFFAOYSA-M |
Product Overview
Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) (CAS 68516-69-8), with molecular formula C14H19NO5S and molecular weight 313.10 g/mol. IUPAC: 6-ethoxy-1,2-dimethylquinolin-1-ium;methyl sulfate.
Chemical Property Profile of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)
Property Insights of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)
The XLogP value of 1.46 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1). The TPSA of 87.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1). Following Lipinski's Rule of Five, Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) 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 Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)?
The CAS number of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) is 68516-69-8.
What is the molecular formula of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)?
The molecular formula of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) is C14H19NO5S.
What is the molecular weight of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)?
The molecular weight of Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) is 313.10 g/mol.
Where can I buy Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)?
You can request a quote for Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1)?
Yes, KEHONG BIO provides custom synthesis services for Quinolinium, 6-ethoxy-1,2-dimethyl-, methyl sulfate (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.