1-(2-Nitrophenyl)pyrazole
TL;DR: 1-(2-Nitrophenyl)pyrazole (CAS 774462-55-4) is a chemical compound with molecular formula C9H7N3O2 and molecular weight 189.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-nitrophenyl)pyrazole
Also Known As: 1-(2-Nitrophenyl)pyrazole, 1-(2-Nitrophenyl)-1H-pyrazole, (2-nitrophenyl)pyrazole, 1-(o-nitrophenyl)-pyrazole, 1H-Pyrazole, 1-(2-nitrophenyl)-
| Molecular Formula | C9H7N3O2 |
|---|---|
| Molecular Weight | 189.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.05383 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 774462-55-4 |
|---|---|
| SMILES | C1=CC=C(C(=C1)N2C=CC=N2)[N+](=O)[O-] |
| InChIKey | OHPLOJFVHRTRPF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(2-Nitrophenyl)pyrazole (CAS 774462-55-4), with molecular formula C9H7N3O2 and molecular weight 189.05 g/mol. IUPAC: 1-(2-nitrophenyl)pyrazole.
Chemical Property Profile of 1-(2-Nitrophenyl)pyrazole
Property Insights of 1-(2-Nitrophenyl)pyrazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(2-Nitrophenyl)pyrazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(2-Nitrophenyl)pyrazole. Following Lipinski's Rule of Five, 1-(2-Nitrophenyl)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 1-(2-Nitrophenyl)pyrazole?
The CAS number of 1-(2-Nitrophenyl)pyrazole is 774462-55-4.
What is the molecular formula of 1-(2-Nitrophenyl)pyrazole?
The molecular formula of 1-(2-Nitrophenyl)pyrazole is C9H7N3O2.
What is the molecular weight of 1-(2-Nitrophenyl)pyrazole?
The molecular weight of 1-(2-Nitrophenyl)pyrazole is 189.05 g/mol.
Where can I buy 1-(2-Nitrophenyl)pyrazole?
You can request a quote for 1-(2-Nitrophenyl)pyrazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2-Nitrophenyl)pyrazole?
Yes, KEHONG BIO provides custom synthesis services for 1-(2-Nitrophenyl)pyrazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.