![1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole structure](/static/products/882/882136-64-3.png)
1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole
TL;DR: 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole (CAS 882136-64-3) is a chemical compound with molecular formula C13H14BrN3O3 and molecular weight 339.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(4-bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole
Also Known As: 1-[2-(4-bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole, 1-[2-(4-bromophenoxy)ethyl]-3,5-dimethyl-4-nitro-1H-pyrazole
| Molecular Formula | C13H14BrN3O3 |
|---|---|
| Molecular Weight | 339.02 g/mol |
| LogP | 3.24964 |
| Topological Polar Surface Area | 70.19 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 339.02185 |
| Heavy Atoms | 20 |
| Complexity | 622.53674 |
Chemical Identifiers
| CAS Number | 882136-64-3 |
|---|---|
| SMILES | CC1=C(C(=NN1CCOC2=CC=C(C=C2)Br)C)[N+](=O)[O-] |
Product Overview
1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole (CAS 882136-64-3), with molecular formula C13H14BrN3O3 and molecular weight 339.02 g/mol. IUPAC: 1-[2-(4-bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole.
Chemical Property Profile of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole
Property Insights of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole
The XLogP value of 3.24964 indicates that 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole. Following Lipinski's Rule of Five, 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole has 0 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 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole?
The CAS number of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole is 882136-64-3.
What is the molecular formula of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole?
The molecular formula of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole is C13H14BrN3O3.
What is the molecular weight of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole?
The molecular weight of 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole is 339.02 g/mol.
Where can I buy 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole?
You can request a quote for 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-[2-(4-Bromophenoxy)ethyl]-3,5-dimethyl-4-nitropyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.