4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one
TL;DR: 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one (CAS 13645-43-7) is a chemical compound with molecular formula C4HCl2N3O3 and molecular weight 208.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dichloro-3-nitro-1H-pyridazin-6-one
Also Known As: 4,5-Dichloro-6-nitropyridazin-3-ol, 4,5-dichloro-6-nitro-2,3-dihydropyridazin-3-one, C4HCl2N3O3, 4,5-dichloro-3-nitro-1H-pyridazin-6-one, 3-Hydroxy-4,5-dichloro-6-nitropyridazine
| Molecular Formula | C4HCl2N3O3 |
|---|---|
| Molecular Weight | 208.94 g/mol |
| LogP | 0.9849 |
| Topological Polar Surface Area | 88.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 208.9395 |
| Heavy Atoms | 12 |
| Complexity | 387.62476 |
Chemical Identifiers
| CAS Number | 13645-43-7 |
|---|---|
| SMILES | C1(=C(C(=NNC1=O)[N+](=O)[O-])Cl)Cl |
Product Overview
4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one (CAS 13645-43-7), with molecular formula C4HCl2N3O3 and molecular weight 208.94 g/mol. IUPAC: 4,5-dichloro-3-nitro-1H-pyridazin-6-one.
Chemical Property Profile of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one
Property Insights of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one
The XLogP value of 0.9849 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one. The TPSA of 88.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one. Following Lipinski's Rule of Five, 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one 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
Frequently Asked Questions
What is the CAS number of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one?
The CAS number of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one is 13645-43-7.
What is the molecular formula of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one?
The molecular formula of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one is C4HCl2N3O3.
What is the molecular weight of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one?
The molecular weight of 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one is 208.94 g/mol.
Where can I buy 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one?
You can request a quote for 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 4,5-Dichloro-6-nitro-2,3-dihydropyridazin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.