Pyridinium, 4-(methoxycarbonyl)-1-methyl-
TL;DR: Pyridinium, 4-(methoxycarbonyl)-1-methyl- (CAS 38117-49-6) is a chemical compound with molecular formula C8H10NO2+ and molecular weight 152.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 1-methylpyridin-1-ium-4-carboxylate
Also Known As: Pyridinium, 4-(methoxycarbonyl)-1-methyl-, methyl 1-methylpyridin-1-ium-4-carboxylate, C8H10NO2+, 4-Methoxycarbonyl-1-methylpyridinium, 4-Methoxycarbonyl-1-methyl-pyridinium
| Molecular Formula | C8H10NO2+ |
|---|---|
| Molecular Weight | 152.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.07115 |
| Heavy Atoms | 11 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 38117-49-6 |
|---|---|
| SMILES | C[N+]1=CC=C(C=C1)C(=O)OC |
| InChIKey | QSTZQJMQOOWRNP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pyridinium, 4-(methoxycarbonyl)-1-methyl- (CAS 38117-49-6), with molecular formula C8H10NO2+ and molecular weight 152.07 g/mol. IUPAC: methyl 1-methylpyridin-1-ium-4-carboxylate.
Chemical Property Profile of Pyridinium, 4-(methoxycarbonyl)-1-methyl-
Property Insights of Pyridinium, 4-(methoxycarbonyl)-1-methyl-
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyridinium, 4-(methoxycarbonyl)-1-methyl-. With a topological polar surface area (TPSA) of 30.2 Ų, Pyridinium, 4-(methoxycarbonyl)-1-methyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 4-(methoxycarbonyl)-1-methyl- 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, 4-(methoxycarbonyl)-1-methyl-?
The CAS number of Pyridinium, 4-(methoxycarbonyl)-1-methyl- is 38117-49-6.
What is the molecular formula of Pyridinium, 4-(methoxycarbonyl)-1-methyl-?
The molecular formula of Pyridinium, 4-(methoxycarbonyl)-1-methyl- is C8H10NO2+.
What is the molecular weight of Pyridinium, 4-(methoxycarbonyl)-1-methyl-?
The molecular weight of Pyridinium, 4-(methoxycarbonyl)-1-methyl- is 152.07 g/mol.
Where can I buy Pyridinium, 4-(methoxycarbonyl)-1-methyl-?
You can request a quote for Pyridinium, 4-(methoxycarbonyl)-1-methyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pyridinium, 4-(methoxycarbonyl)-1-methyl-?
Yes, KEHONG BIO provides custom synthesis services for Pyridinium, 4-(methoxycarbonyl)-1-methyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.