3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one
TL;DR: 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one (CAS 114561-28-3) is a chemical compound with molecular formula C12H13NO3 and molecular weight 219.08954 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2-one
Also Known As: 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one, 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2-one, 3-(hydroxymethyl)-6-methoxy-1-methyl-1,2-dihydroquinolin-2-one, 3-(hydroxymethyl)-6-methoxy-1-methyl-quinolin-2-one, 3-HYDROXYMETHYL-6-METHOXY-1-METHYL-1H-QUINOLIN-2-ONE
Technical Specifications
| Molecular Formula | C12H13NO3 |
| Molecular Weight | 219.08954 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 49.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 219.08954 Da |
| Heavy Atoms | 16 |
| Complexity | 313.0 |
| SMILES | CN1C2=C(C=C(C=C2)OC)C=C(C1=O)CO |
| InChIKey | WTKAOIYWXLMZGW-UHFFFAOYSA-N |
Chemical Property Profile of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one
Property Insights of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one. With a topological polar surface area (TPSA) of 49.8 Ų, 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one?
The CAS number of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one is 114561-28-3.
What is the molecular formula of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one?
The molecular formula of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one is C12H13NO3.
What is the molecular weight of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one?
The molecular weight of 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one is 219.08954 g/mol.
Where can I buy 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one?
You can request a quote for 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one?
Yes, CoreyChem provides custom synthesis services for 3-(hydroxymethyl)-6-methoxy-1-methylquinolin-2(1H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.