![2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol structure](/static/products/1369/136918-70-2.webp)
2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol
TL;DR: 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol (CAS 136918-70-2) is a chemical compound with molecular formula C11H9N3O5S and molecular weight 295.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5,7-dinitroquinolin-8-yl)sulfanylethanol
Also Known As: 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol, 2-(5,7-dinitroquinolin-8-yl)sulfanylethanol, 2-[(5,7-Dinitroquinolin-8-yl)sulfanyl]ethan-1-ol
| Molecular Formula | C11H9N3O5S |
|---|---|
| Molecular Weight | 295.03 g/mol |
| LogP | 2.1356 |
| Topological Polar Surface Area | 119.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 295.0263 |
| Heavy Atoms | 20 |
| Complexity | 691.0581 |
Chemical Identifiers
| CAS Number | 136918-70-2 |
|---|---|
| SMILES | C1=CC2=C(C(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])SCCO)N=C1 |
Product Overview
2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol (CAS 136918-70-2), with molecular formula C11H9N3O5S and molecular weight 295.03 g/mol. IUPAC: 2-(5,7-dinitroquinolin-8-yl)sulfanylethanol.
Chemical Property Profile of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol
Property Insights of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol
The XLogP value of 2.1356 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol. The TPSA of 119.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol. Following Lipinski's Rule of Five, 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol has 1 hydrogen bond donor(s) and 7 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 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol?
The CAS number of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol is 136918-70-2.
What is the molecular formula of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol?
The molecular formula of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol is C11H9N3O5S.
What is the molecular weight of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol?
The molecular weight of 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol is 295.03 g/mol.
Where can I buy 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol?
You can request a quote for 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-[(5,7-Dinitro-8-quinolinyl)thio]ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.