6-Nitroquinoxalin-2-one
TL;DR: 6-Nitroquinoxalin-2-one (CAS 1187830-47-2) is a chemical compound with molecular formula C8H5N3O3 and molecular weight 191.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-nitro-1H-quinoxalin-2-one
Also Known As: 6-Nitroquinoxalin-2-one, 6-nitroquinoxalin-2-ol, 6-nitro-1H-quinoxalin-2-one, 6-nitro-2-quinoxalinol, 6-nitroquinoxalone
| Molecular Formula | C8H5N3O3 |
|---|---|
| Molecular Weight | 191.03 g/mol |
| LogP | 0.8313 |
| Topological Polar Surface Area | 88.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 191.0331 |
| Heavy Atoms | 14 |
| Complexity | 561.0052 |
Chemical Identifiers
| CAS Number | 1187830-47-2 |
|---|---|
| SMILES | C1=CC2=C(C=C1[N+](=O)[O-])N=CC(=O)N2 |
Product Overview
6-Nitroquinoxalin-2-one (CAS 1187830-47-2), with molecular formula C8H5N3O3 and molecular weight 191.03 g/mol. IUPAC: 6-nitro-1H-quinoxalin-2-one.
Chemical Property Profile of 6-Nitroquinoxalin-2-one
Property Insights of 6-Nitroquinoxalin-2-one
The XLogP value of 0.8313 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Nitroquinoxalin-2-one. The TPSA of 88.89 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Nitroquinoxalin-2-one. Following Lipinski's Rule of Five, 6-Nitroquinoxalin-2-one has 1 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 6-Nitroquinoxalin-2-one?
The CAS number of 6-Nitroquinoxalin-2-one is 1187830-47-2.
What is the molecular formula of 6-Nitroquinoxalin-2-one?
The molecular formula of 6-Nitroquinoxalin-2-one is C8H5N3O3.
What is the molecular weight of 6-Nitroquinoxalin-2-one?
The molecular weight of 6-Nitroquinoxalin-2-one is 191.03 g/mol.
Where can I buy 6-Nitroquinoxalin-2-one?
You can request a quote for 6-Nitroquinoxalin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Nitroquinoxalin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Nitroquinoxalin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.