2-Chloronicotinoyl chloride
TL;DR: 2-Chloronicotinoyl chloride (CAS 49609-84-9) is a chemical compound with molecular formula C6H3Cl2NO and molecular weight 174.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloropyridine-3-carbonyl chloride
Also Known As: 2-Chloronicotinoyl chloride, 2-Chloropyridine-3-carbonyl Chloride, 2-Chloronicotinyl chloride, 2-chloro-nicotinoyl chloride, 3-Pyridinecarbonyl chloride, 2-chloro-
| Molecular Formula | C6H3Cl2NO |
|---|---|
| Molecular Weight | 174.96 g/mol |
| LogP | 2.114 |
| Topological Polar Surface Area | 29.96 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.95917 |
| Heavy Atoms | 10 |
| Complexity | 261.67966 |
Chemical Identifiers
| CAS Number | 49609-84-9 |
|---|---|
| SMILES | C1=CC(=C(N=C1)Cl)C(=O)Cl |
Product Overview
2-Chloronicotinoyl chloride (CAS 49609-84-9), with molecular formula C6H3Cl2NO and molecular weight 174.96 g/mol. IUPAC: 2-chloropyridine-3-carbonyl chloride.
Chemical Property Profile of 2-Chloronicotinoyl chloride
Property Insights of 2-Chloronicotinoyl chloride
The XLogP value of 2.114 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloronicotinoyl chloride. With a topological polar surface area (TPSA) of 29.96 Ų, 2-Chloronicotinoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloronicotinoyl chloride 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-Chloronicotinoyl chloride?
The CAS number of 2-Chloronicotinoyl chloride is 49609-84-9.
What is the molecular formula of 2-Chloronicotinoyl chloride?
The molecular formula of 2-Chloronicotinoyl chloride is C6H3Cl2NO.
What is the molecular weight of 2-Chloronicotinoyl chloride?
The molecular weight of 2-Chloronicotinoyl chloride is 174.96 g/mol.
Where can I buy 2-Chloronicotinoyl chloride?
You can request a quote for 2-Chloronicotinoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloronicotinoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloronicotinoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.