1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
TL;DR: 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid (CAS 103854-71-3) is a chemical compound with molecular formula C9H12N2O3 and molecular weight 196.0848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-butyl-6-oxopyridazine-3-carboxylic acid
Also Known As: 1-butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid, 1-butyl-6-oxopyridazine-3-carboxylic acid, 1-butyl-6-oxo-3-pyridazinecarboxylic acid, 1-butyl-6-oxo-pyridazine-3-carboxylic acid, 3-Pyridazinecarboxylicacid, 1-butyl-1,6-dihydro-6-oxo-
Technical Specifications
| Molecular Formula | C9H12N2O3 |
| Molecular Weight | 196.0848 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 70.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.0848 Da |
| Heavy Atoms | 14 |
| Complexity | 307.0 |
| SMILES | CCCCN1C(=O)C=CC(=N1)C(=O)O |
| InChIKey | HPYLRCBYUYKMLK-UHFFFAOYSA-N |
Chemical Property Profile of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
Property Insights of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid. The TPSA of 70.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid. Following Lipinski's Rule of Five, 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid 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
What is the CAS number of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid?
The CAS number of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid is 103854-71-3.
What is the molecular formula of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid?
The molecular formula of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid is C9H12N2O3.
What is the molecular weight of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid?
The molecular weight of 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid is 196.0848 g/mol.
Where can I buy 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid?
You can request a quote for 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid?
Yes, CoreyChem provides custom synthesis services for 1-Butyl-6-oxo-1,6-dihydropyridazine-3-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.