1,3-Dimethyl-5-nitro-1h-indazole
TL;DR: 1,3-Dimethyl-5-nitro-1h-indazole (CAS 58053-50-2) is a chemical compound with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dimethyl-5-nitroindazole
Also Known As: 1,3-dimethyl-5-nitro-1h-indazole, 1,3-dimethyl-5-nitro-indazole, 1,3-dimethyl-5-nitroindazole, 1H-Indazole,1,3-dimethyl-5-nitro-, RefChem:218757
| Molecular Formula | C9H9N3O2 |
|---|---|
| Molecular Weight | 191.07 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 191.06947 |
| Heavy Atoms | 14 |
| Complexity | 241.0 |
Chemical Identifiers
| CAS Number | 58053-50-2 |
|---|---|
| SMILES | CC1=NN(C2=C1C=C(C=C2)[N+](=O)[O-])C |
| InChIKey | IPJSJINXKBSNSI-UHFFFAOYSA-N |
Product Overview
1,3-Dimethyl-5-nitro-1h-indazole (CAS 58053-50-2), with molecular formula C9H9N3O2 and molecular weight 191.07 g/mol. IUPAC: 1,3-dimethyl-5-nitroindazole.
Chemical Property Profile of 1,3-Dimethyl-5-nitro-1h-indazole
Property Insights of 1,3-Dimethyl-5-nitro-1h-indazole
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,3-Dimethyl-5-nitro-1h-indazole. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,3-Dimethyl-5-nitro-1h-indazole. Following Lipinski's Rule of Five, 1,3-Dimethyl-5-nitro-1h-indazole 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 1,3-Dimethyl-5-nitro-1h-indazole?
The CAS number of 1,3-Dimethyl-5-nitro-1h-indazole is 58053-50-2.
What is the molecular formula of 1,3-Dimethyl-5-nitro-1h-indazole?
The molecular formula of 1,3-Dimethyl-5-nitro-1h-indazole is C9H9N3O2.
What is the molecular weight of 1,3-Dimethyl-5-nitro-1h-indazole?
The molecular weight of 1,3-Dimethyl-5-nitro-1h-indazole is 191.07 g/mol.
Where can I buy 1,3-Dimethyl-5-nitro-1h-indazole?
You can request a quote for 1,3-Dimethyl-5-nitro-1h-indazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dimethyl-5-nitro-1h-indazole?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dimethyl-5-nitro-1h-indazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.