3-Chloro-2,5-dinitroindazole
TL;DR: 3-Chloro-2,5-dinitroindazole (CAS 68159-06-8) is a chemical compound with molecular formula C7H3ClN4O4 and molecular weight 241.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-2,5-dinitroindazole
Also Known As: 3-chloro-2,5-dinitroindazole, 2H-Indazole,3-chloro-2,5-dinitro-, 3-Chloro-2,5-dinitro-2H-indazole
| Molecular Formula | C7H3ClN4O4 |
|---|---|
| Molecular Weight | 241.98 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 109.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 241.98428 |
| Heavy Atoms | 16 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 68159-06-8 |
|---|---|
| SMILES | C1=CC2=NN(C(=C2C=C1[N+](=O)[O-])Cl)[N+](=O)[O-] |
| InChIKey | TZUUMLAKXRSPRV-UHFFFAOYSA-N |
Product Overview
3-Chloro-2,5-dinitroindazole (CAS 68159-06-8), with molecular formula C7H3ClN4O4 and molecular weight 241.98 g/mol. IUPAC: 3-chloro-2,5-dinitroindazole.
Chemical Property Profile of 3-Chloro-2,5-dinitroindazole
Property Insights of 3-Chloro-2,5-dinitroindazole
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Chloro-2,5-dinitroindazole. The TPSA of 109.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Chloro-2,5-dinitroindazole. Following Lipinski's Rule of Five, 3-Chloro-2,5-dinitroindazole 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 3-Chloro-2,5-dinitroindazole?
The CAS number of 3-Chloro-2,5-dinitroindazole is 68159-06-8.
What is the molecular formula of 3-Chloro-2,5-dinitroindazole?
The molecular formula of 3-Chloro-2,5-dinitroindazole is C7H3ClN4O4.
What is the molecular weight of 3-Chloro-2,5-dinitroindazole?
The molecular weight of 3-Chloro-2,5-dinitroindazole is 241.98 g/mol.
Where can I buy 3-Chloro-2,5-dinitroindazole?
You can request a quote for 3-Chloro-2,5-dinitroindazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Chloro-2,5-dinitroindazole?
Yes, KEHONG BIO provides custom synthesis services for 3-Chloro-2,5-dinitroindazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.