5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole
TL;DR: 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole (CAS 292826-77-8) is a chemical compound with molecular formula C5H6BrN3O2 and molecular weight 218.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(bromomethyl)-1-methyl-4-nitropyrazole
Also Known As: 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole, 5-(bromomethyl)-1-methyl-4-nitropyrazole, BAS 00170363, 5-Bromomethyl-1-methyl-4-nitro-1H-pyrazole
| Molecular Formula | C5H6BrN3O2 |
|---|---|
| Molecular Weight | 218.96 g/mol |
| LogP | 1.2232 |
| Topological Polar Surface Area | 60.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.96434 |
| Heavy Atoms | 11 |
| Complexity | 283.25494 |
Chemical Identifiers
| CAS Number | 292826-77-8 |
|---|---|
| SMILES | CN1C(=C(C=N1)[N+](=O)[O-])CBr |
Product Overview
5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole (CAS 292826-77-8), with molecular formula C5H6BrN3O2 and molecular weight 218.96 g/mol. IUPAC: 5-(bromomethyl)-1-methyl-4-nitropyrazole.
Chemical Property Profile of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole
Property Insights of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole
The XLogP value of 1.2232 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole. The TPSA of 60.96 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole. Following Lipinski's Rule of Five, 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole has 0 hydrogen bond donor(s) and 3 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 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole?
The CAS number of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole is 292826-77-8.
What is the molecular formula of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole?
The molecular formula of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole is C5H6BrN3O2.
What is the molecular weight of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole?
The molecular weight of 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole is 218.96 g/mol.
Where can I buy 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole?
You can request a quote for 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 5-(bromomethyl)-1-methyl-4-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.