2,3-Dimethylquinolin-4-OL
TL;DR: 2,3-Dimethylquinolin-4-OL (CAS 58596-45-5) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethyl-1H-quinolin-4-one
Also Known As: 2,3-DIMETHYLQUINOLIN-4-OL, 2,3-dimethyl-1H-quinolin-4-one, 2,3-Dimethylquinolin-4(1H)-one, dimethyl-4-quinolinol, 4-Quinolinol,2,3-dimethyl-
| Molecular Formula | C11H11NO |
|---|---|
| Molecular Weight | 173.08 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.08406 |
| Heavy Atoms | 13 |
| Complexity | 267.0 |
Chemical Identifiers
| CAS Number | 58596-45-5 |
|---|---|
| SMILES | CC1=C(NC2=CC=CC=C2C1=O)C |
| InChIKey | ZCHAUSWCWZYCNG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Dimethylquinolin-4-OL (CAS 58596-45-5), with molecular formula C11H11NO and molecular weight 173.08 g/mol. IUPAC: 2,3-dimethyl-1H-quinolin-4-one.
Chemical Property Profile of 2,3-Dimethylquinolin-4-OL
Property Insights of 2,3-Dimethylquinolin-4-OL
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dimethylquinolin-4-OL. With a topological polar surface area (TPSA) of 29.1 Ų, 2,3-Dimethylquinolin-4-OL exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Dimethylquinolin-4-OL has 1 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 2,3-Dimethylquinolin-4-OL?
The CAS number of 2,3-Dimethylquinolin-4-OL is 58596-45-5.
What is the molecular formula of 2,3-Dimethylquinolin-4-OL?
The molecular formula of 2,3-Dimethylquinolin-4-OL is C11H11NO.
What is the molecular weight of 2,3-Dimethylquinolin-4-OL?
The molecular weight of 2,3-Dimethylquinolin-4-OL is 173.08 g/mol.
Where can I buy 2,3-Dimethylquinolin-4-OL?
You can request a quote for 2,3-Dimethylquinolin-4-OL directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Dimethylquinolin-4-OL?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Dimethylquinolin-4-OL and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.