1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride
TL;DR: 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride (CAS 1075-56-5) is a chemical compound with molecular formula C8H8Cl3N and molecular weight 222.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2,3-dichloroprop-2-enyl)pyridin-1-ium chloride
Also Known As: 1-(2,3-Dichloroallyl)pyridinium chloride, Pyridinium,1-(2,3-dichloro-2-propen-1-yl)-, chloride (1:1)
| Molecular Formula | C8H8Cl3N |
|---|---|
| Molecular Weight | 222.97 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 222.97223 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 1075-56-5 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)CC(=CCl)Cl.[Cl-] |
| InChIKey | RFRQQNJDUQXAAS-UHFFFAOYSA-M |
Product Overview
1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride (CAS 1075-56-5), with molecular formula C8H8Cl3N and molecular weight 222.97 g/mol. IUPAC: 1-(2,3-dichloroprop-2-enyl)pyridin-1-ium chloride.
Chemical Property Profile of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride
Property Insights of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride
The XLogP value of -0.7 indicates that 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.9 Ų, 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride 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 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride?
The CAS number of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride is 1075-56-5.
What is the molecular formula of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride?
The molecular formula of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride is C8H8Cl3N.
What is the molecular weight of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride?
The molecular weight of 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride is 222.97 g/mol.
Where can I buy 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride?
You can request a quote for 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(2,3-Dichloroprop-2-enyl)pyridin-1-ium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.