3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol
TL;DR: 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol (CAS 132-42-3) is a chemical compound with molecular formula C10H8N4O5 and molecular weight 264.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-4-nitro-2-(4-nitrophenyl)-1H-pyrazol-3-one
Also Known As: Picrolonic acid, 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol, PICROLONIC ACID [MI], 4-Bromo-2-fluoro-5-iodotoluene, 5-methyl-4-nitro-2-(4-nitrophenyl)-1H-pyrazol-3-one
| Molecular Formula | C10H8N4O5 |
|---|---|
| Molecular Weight | 264.05 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 264.04947 |
| Heavy Atoms | 19 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 132-42-3 |
|---|---|
| SMILES | CC1=C(C(=O)N(N1)C2=CC=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | JROWKMSMOKJXDW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol (CAS 132-42-3), with molecular formula C10H8N4O5 and molecular weight 264.05 g/mol. IUPAC: 5-methyl-4-nitro-2-(4-nitrophenyl)-1H-pyrazol-3-one.
Chemical Property Profile of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol
Property Insights of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol. Following Lipinski's Rule of Five, 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol has 1 hydrogen bond donor(s) and 6 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 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol?
The CAS number of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol is 132-42-3.
What is the molecular formula of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol?
The molecular formula of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol is C10H8N4O5.
What is the molecular weight of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol?
The molecular weight of 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol is 264.05 g/mol.
Where can I buy 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol?
You can request a quote for 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-4-nitro-1-(4-nitrophenyl)-1H-pyrazol-5-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.