2-Chloro-5,6,7,8-tetrahydroquinolin-5-one
TL;DR: 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one (CAS 124467-36-3) is a chemical compound with molecular formula C9H8ClNO and molecular weight 181.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-7,8-dihydro-6H-quinolin-5-one
Also Known As: 2-chloro-7,8-dihydroquinolin-5(6H)-one, 2-chloro-7,8-dihydro-6H-quinolin-5-one, 5(6H)-QUINOLINONE, 2-CHLORO-7,8-DIHYDRO-, 2-Chloro-7,8-dihydro-5(6H)-quinolinone, 1671AJ
| Molecular Formula | C9H8ClNO |
|---|---|
| Molecular Weight | 181.03 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 181.02943 |
| Heavy Atoms | 12 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 124467-36-3 |
|---|---|
| SMILES | C1CC2=C(C=CC(=N2)Cl)C(=O)C1 |
| InChIKey | GWDDFDLEOYOZLY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Chloro-5,6,7,8-tetrahydroquinolin-5-one (CAS 124467-36-3), with molecular formula C9H8ClNO and molecular weight 181.03 g/mol. IUPAC: 2-chloro-7,8-dihydro-6H-quinolin-5-one.
Chemical Property Profile of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one
Property Insights of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one. With a topological polar surface area (TPSA) of 30.0 Ų, 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one 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 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one?
The CAS number of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one is 124467-36-3.
What is the molecular formula of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one?
The molecular formula of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one is C9H8ClNO.
What is the molecular weight of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one?
The molecular weight of 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one is 181.03 g/mol.
Where can I buy 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one?
You can request a quote for 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-5,6,7,8-tetrahydroquinolin-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.