Quinolin-8-yl chloroacetate
TL;DR: Quinolin-8-yl chloroacetate (CAS 5568-49-0) is a chemical compound with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
quinolin-8-yl 2-chloroacetate
Also Known As: quinolin-8-yl 2-chloroacetate, quinolin-8-yl chloroacetate
| Molecular Formula | C11H8ClNO2 |
|---|---|
| Molecular Weight | 221.02 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 221.02435 |
| Heavy Atoms | 15 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 5568-49-0 |
|---|---|
| SMILES | C1=CC2=C(C(=C1)OC(=O)CCl)N=CC=C2 |
| InChIKey | NUCFGSRTIHFHHP-UHFFFAOYSA-N |
Product Overview
Quinolin-8-yl chloroacetate (CAS 5568-49-0), with molecular formula C11H8ClNO2 and molecular weight 221.02 g/mol. IUPAC: quinolin-8-yl 2-chloroacetate.
Chemical Property Profile of Quinolin-8-yl chloroacetate
Property Insights of Quinolin-8-yl chloroacetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Quinolin-8-yl chloroacetate. With a topological polar surface area (TPSA) of 39.2 Ų, Quinolin-8-yl chloroacetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Quinolin-8-yl chloroacetate has 0 hydrogen bond donor(s) and 3 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 Quinolin-8-yl chloroacetate?
The CAS number of Quinolin-8-yl chloroacetate is 5568-49-0.
What is the molecular formula of Quinolin-8-yl chloroacetate?
The molecular formula of Quinolin-8-yl chloroacetate is C11H8ClNO2.
What is the molecular weight of Quinolin-8-yl chloroacetate?
The molecular weight of Quinolin-8-yl chloroacetate is 221.02 g/mol.
Where can I buy Quinolin-8-yl chloroacetate?
You can request a quote for Quinolin-8-yl chloroacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Quinolin-8-yl chloroacetate?
Yes, KEHONG BIO provides custom synthesis services for Quinolin-8-yl chloroacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.