1-Methyl-3,5-dinitropyrazole
TL;DR: 1-Methyl-3,5-dinitropyrazole (CAS 32683-48-0) is a chemical compound with molecular formula C4H4N4O4 and molecular weight 172.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-3,5-dinitropyrazole
Also Known As: 1-Methyl-3,5-dinitropyrazole, 1-methyl-3,5-dinitro-1H-pyrazole, 3,5-Dinitro-1-methyl-pyrazol, 1H-PYRAZOLE,1-METHYL-3,5-DINITRO-, RefChem:231699
| Molecular Formula | C4H4N4O4 |
|---|---|
| Molecular Weight | 172.02 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.02325 |
| Heavy Atoms | 12 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 32683-48-0 |
|---|---|
| SMILES | CN1C(=CC(=N1)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | UWSPNIADTGDCIW-UHFFFAOYSA-N |
Product Overview
1-Methyl-3,5-dinitropyrazole (CAS 32683-48-0), with molecular formula C4H4N4O4 and molecular weight 172.02 g/mol. IUPAC: 1-methyl-3,5-dinitropyrazole.
Chemical Property Profile of 1-Methyl-3,5-dinitropyrazole
Property Insights of 1-Methyl-3,5-dinitropyrazole
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-3,5-dinitropyrazole. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-3,5-dinitropyrazole. Following Lipinski's Rule of Five, 1-Methyl-3,5-dinitropyrazole has 0 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 1-Methyl-3,5-dinitropyrazole?
The CAS number of 1-Methyl-3,5-dinitropyrazole is 32683-48-0.
What is the molecular formula of 1-Methyl-3,5-dinitropyrazole?
The molecular formula of 1-Methyl-3,5-dinitropyrazole is C4H4N4O4.
What is the molecular weight of 1-Methyl-3,5-dinitropyrazole?
The molecular weight of 1-Methyl-3,5-dinitropyrazole is 172.02 g/mol.
Where can I buy 1-Methyl-3,5-dinitropyrazole?
You can request a quote for 1-Methyl-3,5-dinitropyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-3,5-dinitropyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-3,5-dinitropyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.