1-(6-Nitroindazol-2-yl)ethanone
TL;DR: 1-(6-Nitroindazol-2-yl)ethanone (CAS 13572-31-1) is a chemical compound with molecular formula C9H7N3O3 and molecular weight 205.04874 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(6-nitroindazol-2-yl)ethanone
Also Known As: 1-(6-nitroindazol-2-yl)ethanone, 1-(6-Nitro-2H-indazol-2-yl)ethan-1-one
Technical Specifications
| Molecular Formula | C9H7N3O3 |
| Molecular Weight | 205.04874 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 80.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 205.04874 Da |
| Heavy Atoms | 15 |
| Complexity | 289.0 |
| SMILES | CC(=O)N1C=C2C=CC(=CC2=N1)[N+](=O)[O-] |
| InChIKey | ZVXDKPRGTJMFTC-UHFFFAOYSA-N |
Chemical Property Profile of 1-(6-Nitroindazol-2-yl)ethanone
Property Insights of 1-(6-Nitroindazol-2-yl)ethanone
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Nitroindazol-2-yl)ethanone. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-Nitroindazol-2-yl)ethanone. Following Lipinski's Rule of Five, 1-(6-Nitroindazol-2-yl)ethanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-(6-Nitroindazol-2-yl)ethanone?
The CAS number of 1-(6-Nitroindazol-2-yl)ethanone is 13572-31-1.
What is the molecular formula of 1-(6-Nitroindazol-2-yl)ethanone?
The molecular formula of 1-(6-Nitroindazol-2-yl)ethanone is C9H7N3O3.
What is the molecular weight of 1-(6-Nitroindazol-2-yl)ethanone?
The molecular weight of 1-(6-Nitroindazol-2-yl)ethanone is 205.04874 g/mol.
Where can I buy 1-(6-Nitroindazol-2-yl)ethanone?
You can request a quote for 1-(6-Nitroindazol-2-yl)ethanone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-(6-Nitroindazol-2-yl)ethanone?
Yes, CoreyChem provides custom synthesis services for 1-(6-Nitroindazol-2-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.