3,6-bis(hydroxymethyl)-1H-pyridazin-4-one
TL;DR: 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one (CAS 17417-44-6) is a chemical compound with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,6-bis(hydroxymethyl)-1H-pyridazin-4-one
Also Known As: 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one, 3,6-bis-hydroxymethyl-1H-pyridazin-4-one, 3,6-Bis(hydroxymethyl)pyridazin-4(1H)-one, 4(1H)-Pyridazinone, 3,6-bis(hydroxymethyl)-
| Molecular Formula | C6H8N2O3 |
|---|---|
| Molecular Weight | 156.05 g/mol |
| LogP | -1.1 |
| Topological Polar Surface Area | 81.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 156.0535 |
| Heavy Atoms | 11 |
| Complexity | 232.0 |
Chemical Identifiers
| CAS Number | 17417-44-6 |
|---|---|
| SMILES | C1=C(NN=C(C1=O)CO)CO |
| InChIKey | CTONGHUGUSEONX-UHFFFAOYSA-N |
Product Overview
3,6-bis(hydroxymethyl)-1H-pyridazin-4-one (CAS 17417-44-6), with molecular formula C6H8N2O3 and molecular weight 156.05 g/mol. IUPAC: 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one.
Chemical Property Profile of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one
Property Insights of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one
The XLogP value of -1.1 indicates that 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one. Following Lipinski's Rule of Five, 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one has 3 hydrogen bond donor(s) and 5 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 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one?
The CAS number of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one is 17417-44-6.
What is the molecular formula of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one?
The molecular formula of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one is C6H8N2O3.
What is the molecular weight of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one?
The molecular weight of 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one is 156.05 g/mol.
Where can I buy 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one?
You can request a quote for 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one?
Yes, KEHONG BIO provides custom synthesis services for 3,6-bis(hydroxymethyl)-1H-pyridazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.