6-chloro-3H-pyridin-2-one
TL;DR: 6-chloro-3H-pyridin-2-one (CAS 887570-97-0) is a chemical compound with molecular formula C5H4ClNO and molecular weight 129.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3H-pyridin-2-one
Also Known As: 6-chloro-3H-pyridin-2-one, Togni's Reagent, 6-CHLORO-2(3H)-PYRIDINONE, 6-Chloropyridn-2-ol, 2(3H)-Pyridinone,6-chloro-
| Molecular Formula | C5H4ClNO |
|---|---|
| Molecular Weight | 129.00 g/mol |
| LogP | 1.1102 |
| Topological Polar Surface Area | 29.43 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 128.99814 |
| Heavy Atoms | 8 |
| Complexity | 171.26749 |
Chemical Identifiers
| CAS Number | 887570-97-0 |
|---|---|
| SMILES | C1C=CC(=NC1=O)Cl |
Product Overview
6-chloro-3H-pyridin-2-one (CAS 887570-97-0), with molecular formula C5H4ClNO and molecular weight 129.00 g/mol. IUPAC: 6-chloro-3H-pyridin-2-one.
Chemical Property Profile of 6-chloro-3H-pyridin-2-one
Property Insights of 6-chloro-3H-pyridin-2-one
The XLogP value of 1.1102 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-chloro-3H-pyridin-2-one. With a topological polar surface area (TPSA) of 29.43 Ų, 6-chloro-3H-pyridin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-chloro-3H-pyridin-2-one has 0 hydrogen bond donor(s) and 1 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-chloro-3H-pyridin-2-one?
The CAS number of 6-chloro-3H-pyridin-2-one is 887570-97-0.
What is the molecular formula of 6-chloro-3H-pyridin-2-one?
The molecular formula of 6-chloro-3H-pyridin-2-one is C5H4ClNO.
What is the molecular weight of 6-chloro-3H-pyridin-2-one?
The molecular weight of 6-chloro-3H-pyridin-2-one is 129.00 g/mol.
Where can I buy 6-chloro-3H-pyridin-2-one?
You can request a quote for 6-chloro-3H-pyridin-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-chloro-3H-pyridin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-chloro-3H-pyridin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.