4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole
TL;DR: 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole (CAS 1002243-75-5) is a chemical compound with molecular formula C10H7Cl2N3O2 and molecular weight 270.99155 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-chloro-1-[(4-chlorophenyl)methyl]-3-nitropyrazole
Also Known As: 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole, 4-Chloro-1-(4-chloro-benzyl)-3-nitro-1H-pyrazole, 4-chloro-1-[(4-chlorophenyl)methyl]-3-nitropyrazole, 4-chloro-1-[(4-chlorophenyl)methyl]-3-nitro-1H-pyrazole, 4-chloro-1-[(4-chlorophenyl)methyl]-3-nitro-pyrazole
Technical Specifications
| Molecular Formula | C10H7Cl2N3O2 |
| Molecular Weight | 270.99155 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 270.99155 Da |
| Heavy Atoms | 17 |
| Complexity | 279.0 |
| SMILES | C1=CC(=CC=C1CN2C=C(C(=N2)[N+](=O)[O-])Cl)Cl |
| InChIKey | ZMMHJENKFLBBRN-UHFFFAOYSA-N |
Chemical Property Profile of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole
Property Insights of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole
The XLogP value of 3.2 indicates that 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole. Following Lipinski's Rule of Five, 4-chloro-1-(4-chlorobenzyl)-3-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
What is the CAS number of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole?
The CAS number of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole is 1002243-75-5.
What is the molecular formula of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole?
The molecular formula of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole is C10H7Cl2N3O2.
What is the molecular weight of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole?
The molecular weight of 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole is 270.99155 g/mol.
Where can I buy 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole?
You can request a quote for 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-chloro-1-(4-chlorobenzyl)-3-nitro-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.