4-(2-nitrophenyl)-1H-pyrazole
TL;DR: 4-(2-nitrophenyl)-1H-pyrazole (CAS 1022318-67-7) is a chemical compound with molecular formula C9H7N3O2 and molecular weight 189.05383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-nitrophenyl)-1H-pyrazole
Also Known As: 4-(2-nitrophenyl)-1H-pyrazole, 4-(2-nitrophenyl)pyrazole, G73340
Technical Specifications
| Molecular Formula | C9H7N3O2 |
| Molecular Weight | 189.05383 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.05383 Da |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
| SMILES | C1=CC=C(C(=C1)C2=CNN=C2)[N+](=O)[O-] |
| InChIKey | YHKKJSANXASGJT-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2-nitrophenyl)-1H-pyrazole
Property Insights of 4-(2-nitrophenyl)-1H-pyrazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-nitrophenyl)-1H-pyrazole. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-nitrophenyl)-1H-pyrazole. Following Lipinski's Rule of Five, 4-(2-nitrophenyl)-1H-pyrazole has 1 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-(2-nitrophenyl)-1H-pyrazole?
The CAS number of 4-(2-nitrophenyl)-1H-pyrazole is 1022318-67-7.
What is the molecular formula of 4-(2-nitrophenyl)-1H-pyrazole?
The molecular formula of 4-(2-nitrophenyl)-1H-pyrazole is C9H7N3O2.
What is the molecular weight of 4-(2-nitrophenyl)-1H-pyrazole?
The molecular weight of 4-(2-nitrophenyl)-1H-pyrazole is 189.05383 g/mol.
Where can I buy 4-(2-nitrophenyl)-1H-pyrazole?
You can request a quote for 4-(2-nitrophenyl)-1H-pyrazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2-nitrophenyl)-1H-pyrazole?
Yes, CoreyChem provides custom synthesis services for 4-(2-nitrophenyl)-1H-pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.