Quinoxaline, 2-chloro-, 4-oxide
TL;DR: Quinoxaline, 2-chloro-, 4-oxide (CAS 5227-59-8) is a chemical compound with molecular formula C8H5ClN2O and molecular weight 180.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-chloro-1-oxidoquinoxalin-1-ium
Also Known As: 3-Chloroquinoxaline 1-oxide, Quinoxaline, 2-chloro-, 4-oxide, 2-Chloroquinoxaline 4-oxide, 2-Chloroquinoxaline-4-oxide, 3-chloro-1-oxidoquinoxalin-1-ium
| Molecular Formula | C8H5ClN2O |
|---|---|
| Molecular Weight | 180.01 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.00903 |
| Heavy Atoms | 12 |
| Complexity | 167.0 |
Chemical Identifiers
| CAS Number | 5227-59-8 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N=C(C=[N+]2[O-])Cl |
| InChIKey | ZHMAMGXARKYXTG-UHFFFAOYSA-N |
Product Overview
Quinoxaline, 2-chloro-, 4-oxide (CAS 5227-59-8), with molecular formula C8H5ClN2O and molecular weight 180.01 g/mol. IUPAC: 3-chloro-1-oxidoquinoxalin-1-ium.
Chemical Property Profile of Quinoxaline, 2-chloro-, 4-oxide
Property Insights of Quinoxaline, 2-chloro-, 4-oxide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinoxaline, 2-chloro-, 4-oxide. With a topological polar surface area (TPSA) of 38.4 Ų, Quinoxaline, 2-chloro-, 4-oxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinoxaline, 2-chloro-, 4-oxide has 0 hydrogen bond donor(s) and 2 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 Quinoxaline, 2-chloro-, 4-oxide?
The CAS number of Quinoxaline, 2-chloro-, 4-oxide is 5227-59-8.
What is the molecular formula of Quinoxaline, 2-chloro-, 4-oxide?
The molecular formula of Quinoxaline, 2-chloro-, 4-oxide is C8H5ClN2O.
What is the molecular weight of Quinoxaline, 2-chloro-, 4-oxide?
The molecular weight of Quinoxaline, 2-chloro-, 4-oxide is 180.01 g/mol.
Where can I buy Quinoxaline, 2-chloro-, 4-oxide?
You can request a quote for Quinoxaline, 2-chloro-, 4-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinoxaline, 2-chloro-, 4-oxide?
Yes, KEHONG BIO provides custom synthesis services for Quinoxaline, 2-chloro-, 4-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.