1-(6-Nitroindazol-2-yl)propan-1-one
TL;DR: 1-(6-Nitroindazol-2-yl)propan-1-one (CAS 55076-16-9) is a chemical compound with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(6-nitroindazol-2-yl)propan-1-one
Also Known As: 1-(6-nitroindazol-2-yl)propan-1-one, 1-(6-Nitro-2H-indazol-2-yl)propan-1-one
| Molecular Formula | C10H9N3O3 |
|---|---|
| Molecular Weight | 219.06 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 80.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 219.06439 |
| Heavy Atoms | 16 |
| Complexity | 302.0 |
Chemical Identifiers
| CAS Number | 55076-16-9 |
|---|---|
| SMILES | CCC(=O)N1C=C2C=CC(=CC2=N1)[N+](=O)[O-] |
| InChIKey | IOQDOCBNMCJDKE-UHFFFAOYSA-N |
Product Overview
1-(6-Nitroindazol-2-yl)propan-1-one (CAS 55076-16-9), with molecular formula C10H9N3O3 and molecular weight 219.06 g/mol. IUPAC: 1-(6-nitroindazol-2-yl)propan-1-one.
Chemical Property Profile of 1-(6-Nitroindazol-2-yl)propan-1-one
Property Insights of 1-(6-Nitroindazol-2-yl)propan-1-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(6-Nitroindazol-2-yl)propan-1-one. The TPSA of 80.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(6-Nitroindazol-2-yl)propan-1-one. Following Lipinski's Rule of Five, 1-(6-Nitroindazol-2-yl)propan-1-one 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
Frequently Asked Questions
What is the CAS number of 1-(6-Nitroindazol-2-yl)propan-1-one?
The CAS number of 1-(6-Nitroindazol-2-yl)propan-1-one is 55076-16-9.
What is the molecular formula of 1-(6-Nitroindazol-2-yl)propan-1-one?
The molecular formula of 1-(6-Nitroindazol-2-yl)propan-1-one is C10H9N3O3.
What is the molecular weight of 1-(6-Nitroindazol-2-yl)propan-1-one?
The molecular weight of 1-(6-Nitroindazol-2-yl)propan-1-one is 219.06 g/mol.
Where can I buy 1-(6-Nitroindazol-2-yl)propan-1-one?
You can request a quote for 1-(6-Nitroindazol-2-yl)propan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(6-Nitroindazol-2-yl)propan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(6-Nitroindazol-2-yl)propan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.