1,5-dimethyl-3,4-dinitro-1H-pyrazole
TL;DR: 1,5-dimethyl-3,4-dinitro-1H-pyrazole (CAS 76368-86-0) is a chemical compound with molecular formula C5H6N4O4 and molecular weight 186.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,5-dimethyl-3,4-dinitropyrazole
Also Known As: 1,5-dimethyl-3,4-dinitropyrazole, 1,5-dimethyl-3,4-dinitro-1H-pyrazole, 1H-Pyrazole, 1,5-dimethyl-3,4-dinitro-, RefChem:221328
| Molecular Formula | C5H6N4O4 |
|---|---|
| Molecular Weight | 186.04 g/mol |
| LogP | 0.54492 |
| Topological Polar Surface Area | 104.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 186.03891 |
| Heavy Atoms | 13 |
| Complexity | 382.13126 |
Chemical Identifiers
| CAS Number | 76368-86-0 |
|---|---|
| SMILES | CC1=C(C(=NN1C)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
1,5-dimethyl-3,4-dinitro-1H-pyrazole (CAS 76368-86-0), with molecular formula C5H6N4O4 and molecular weight 186.04 g/mol. IUPAC: 1,5-dimethyl-3,4-dinitropyrazole.
Chemical Property Profile of 1,5-dimethyl-3,4-dinitro-1H-pyrazole
Property Insights of 1,5-dimethyl-3,4-dinitro-1H-pyrazole
The XLogP value of 0.54492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,5-dimethyl-3,4-dinitro-1H-pyrazole. The TPSA of 104.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,5-dimethyl-3,4-dinitro-1H-pyrazole. Following Lipinski's Rule of Five, 1,5-dimethyl-3,4-dinitro-1H-pyrazole 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 1,5-dimethyl-3,4-dinitro-1H-pyrazole?
The CAS number of 1,5-dimethyl-3,4-dinitro-1H-pyrazole is 76368-86-0.
What is the molecular formula of 1,5-dimethyl-3,4-dinitro-1H-pyrazole?
The molecular formula of 1,5-dimethyl-3,4-dinitro-1H-pyrazole is C5H6N4O4.
What is the molecular weight of 1,5-dimethyl-3,4-dinitro-1H-pyrazole?
The molecular weight of 1,5-dimethyl-3,4-dinitro-1H-pyrazole is 186.04 g/mol.
Where can I buy 1,5-dimethyl-3,4-dinitro-1H-pyrazole?
You can request a quote for 1,5-dimethyl-3,4-dinitro-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,5-dimethyl-3,4-dinitro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1,5-dimethyl-3,4-dinitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.