2,5-Dinitro-2H-indazole
TL;DR: 2,5-Dinitro-2H-indazole (CAS 31164-29-1) is a chemical compound with molecular formula C7H4N4O4 and molecular weight 208.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dinitroindazole
Also Known As: 2,5-Dinitro-2H-indazole, 2,5-dinitroindazole, 2H-Indazole, 2,5-dinitro-, RefChem:247640
| Molecular Formula | C7H4N4O4 |
|---|---|
| Molecular Weight | 208.02 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 208.02325 |
| Heavy Atoms | 15 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 31164-29-1 |
|---|---|
| SMILES | C1=CC2=NN(C=C2C=C1[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | OLQMYJIVJQYMNX-UHFFFAOYSA-N |
Product Overview
2,5-Dinitro-2H-indazole (CAS 31164-29-1), with molecular formula C7H4N4O4 and molecular weight 208.02 g/mol. IUPAC: 2,5-dinitroindazole.
Chemical Property Profile of 2,5-Dinitro-2H-indazole
Property Insights of 2,5-Dinitro-2H-indazole
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dinitro-2H-indazole. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,5-Dinitro-2H-indazole. Following Lipinski's Rule of Five, 2,5-Dinitro-2H-indazole has 0 hydrogen bond donor(s) and 5 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 2,5-Dinitro-2H-indazole?
The CAS number of 2,5-Dinitro-2H-indazole is 31164-29-1.
What is the molecular formula of 2,5-Dinitro-2H-indazole?
The molecular formula of 2,5-Dinitro-2H-indazole is C7H4N4O4.
What is the molecular weight of 2,5-Dinitro-2H-indazole?
The molecular weight of 2,5-Dinitro-2H-indazole is 208.02 g/mol.
Where can I buy 2,5-Dinitro-2H-indazole?
You can request a quote for 2,5-Dinitro-2H-indazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dinitro-2H-indazole?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dinitro-2H-indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.