3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid
TL;DR: 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid (CAS 4572-79-6) is a chemical compound with molecular formula C7H8N2O4 and molecular weight 184.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,6-dioxo-1H-pyridazin-2-yl)propanoic acid
Also Known As: 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid, 3-(3,6-dioxo-1H-pyridazin-2-yl)propanoic acid, 3-(3,6-dioxo-1,2,3,6-tetrahydropyridazin-1-yl)propanoic acid, 3-(3,6-dioxo-3,6-dihydropyridazin-1(2H)-yl)propanoic acid, 2-(trifluoromethyl)cyclohexanamine
| Molecular Formula | C7H8N2O4 |
|---|---|
| Molecular Weight | 184.05 g/mol |
| LogP | -1.3 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 184.0484 |
| Heavy Atoms | 13 |
| Complexity | 284.0 |
Chemical Identifiers
| CAS Number | 4572-79-6 |
|---|---|
| SMILES | C1=CC(=O)N(NC1=O)CCC(=O)O |
| InChIKey | PJMGVDKZHXIURV-UHFFFAOYSA-N |
Product Overview
3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid (CAS 4572-79-6), with molecular formula C7H8N2O4 and molecular weight 184.05 g/mol. IUPAC: 3-(3,6-dioxo-1H-pyridazin-2-yl)propanoic acid.
Chemical Property Profile of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid
Property Insights of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid
The XLogP value of -1.3 indicates that 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid. Following Lipinski's Rule of Five, 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid has 2 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 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid?
The CAS number of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid is 4572-79-6.
What is the molecular formula of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid?
The molecular formula of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid is C7H8N2O4.
What is the molecular weight of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid?
The molecular weight of 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid is 184.05 g/mol.
Where can I buy 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid?
You can request a quote for 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(3-Hydroxy-6-oxo-6H-pyridazin-1-yl)-propionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.