1-(Cyanomethyl)pyridinium chloride
TL;DR: 1-(Cyanomethyl)pyridinium chloride (CAS 17281-59-3) is a chemical compound with molecular formula C7H7ClN2 and molecular weight 154.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pyridin-1-ium-1-ylacetonitrile chloride
Also Known As: 1-(Cyanomethyl)pyridinium chloride, 1-(cyanomethyl)pyridin-1-ium chloride, N-(CYANOMETHYL)PYRIDINIUM CHLORIDE, 2-(trimethylacetyl)thiophene, cyanomethylpyridinium chloride
| Molecular Formula | C7H7ClN2 |
|---|---|
| Molecular Weight | 154.03 g/mol |
| LogP | -2.49832 |
| Topological Polar Surface Area | 27.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 154.02977 |
| Heavy Atoms | 10 |
| Complexity | 214.79776 |
Chemical Identifiers
| CAS Number | 17281-59-3 |
|---|---|
| SMILES | C1=CC=[N+](C=C1)CC#N.[Cl-] |
Product Overview
1-(Cyanomethyl)pyridinium chloride (CAS 17281-59-3), with molecular formula C7H7ClN2 and molecular weight 154.03 g/mol. IUPAC: 2-pyridin-1-ium-1-ylacetonitrile chloride.
Chemical Property Profile of 1-(Cyanomethyl)pyridinium chloride
Property Insights of 1-(Cyanomethyl)pyridinium chloride
The XLogP value of -2.49832 indicates that 1-(Cyanomethyl)pyridinium chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 27.67 Ų, 1-(Cyanomethyl)pyridinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Cyanomethyl)pyridinium 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-(Cyanomethyl)pyridinium chloride?
The CAS number of 1-(Cyanomethyl)pyridinium chloride is 17281-59-3.
What is the molecular formula of 1-(Cyanomethyl)pyridinium chloride?
The molecular formula of 1-(Cyanomethyl)pyridinium chloride is C7H7ClN2.
What is the molecular weight of 1-(Cyanomethyl)pyridinium chloride?
The molecular weight of 1-(Cyanomethyl)pyridinium chloride is 154.03 g/mol.
Where can I buy 1-(Cyanomethyl)pyridinium chloride?
You can request a quote for 1-(Cyanomethyl)pyridinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Cyanomethyl)pyridinium chloride?
Yes, KEHONG BIO provides custom synthesis services for 1-(Cyanomethyl)pyridinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.