5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one
TL;DR: 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one (CAS 71407-96-0) is a chemical compound with molecular formula C10H11NO4 and molecular weight 209.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-acetyl-6-methyl-2-oxo-1H-pyridine-3-carboxylate
Also Known As: BAS 01884755, 5-acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one, methyl 5-acetyl-6-methyl-2-oxo-1H-pyridine-3-carboxylate, methyl 5-acetyl-1,2-dihydro-6-methyl-2-oxopyridine-3-carboxylate, methyl 5-acetyl-6-methyl-2-oxo-1,2-dihydro-3-pyridinecarboxylate
| Molecular Formula | C10H11NO4 |
|---|---|
| Molecular Weight | 209.07 g/mol |
| LogP | 0.67252 |
| Topological Polar Surface Area | 76.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 209.0688 |
| Heavy Atoms | 15 |
| Complexity | 472.801 |
Chemical Identifiers
| CAS Number | 71407-96-0 |
|---|---|
| SMILES | CC1=C(C=C(C(=O)N1)C(=O)OC)C(=O)C |
Product Overview
5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one (CAS 71407-96-0), with molecular formula C10H11NO4 and molecular weight 209.07 g/mol. IUPAC: methyl 5-acetyl-6-methyl-2-oxo-1H-pyridine-3-carboxylate.
Chemical Property Profile of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one
Property Insights of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one
The XLogP value of 0.67252 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one. The TPSA of 76.23 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one. Following Lipinski's Rule of Five, 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one has 1 hydrogen bond donor(s) and 4 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 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one?
The CAS number of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one is 71407-96-0.
What is the molecular formula of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one?
The molecular formula of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one is C10H11NO4.
What is the molecular weight of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one?
The molecular weight of 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one is 209.07 g/mol.
Where can I buy 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one?
You can request a quote for 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one?
Yes, KEHONG BIO provides custom synthesis services for 5-Acetyl-3-methoxycarbonyl-6-methylpyridin-2(1h)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.