![Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) structure](/static/products/7085/70851-62-6.webp)
Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)
TL;DR: Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) (CAS 70851-62-6) is a chemical compound with molecular formula C10H11ClN2O2 and molecular weight 226.0509 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-pyridin-1-ium-1-ylethyl 2-cyanoacetate chloride
Also Known As: KST-1B8197, 1-[2-(2-cyanoacetoxy)ethyl]pyridinium chloride, 1-(2-(2-Cyano-1-oxoethoxy)ethyl)pyridinium, chloride, Pyridinium, 1-(2-((cyanoacetyl)oxy)ethyl)-, chloride, 2-pyridin-1-ium-1-ylethyl 2-cyanoacetate chloride
Technical Specifications
| Molecular Formula | C10H11ClN2O2 |
| Molecular Weight | 226.0509 g/mol |
| XLogP | -2.57 |
| Topological Polar Surface Area (TPSA) | 54.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.0509 Da |
| Heavy Atoms | 15 |
| Complexity | 226.0 |
| SMILES | C1=CC=[N+](C=C1)CCOC(=O)CC#N.[Cl-] |
| InChIKey | QSHHZCWAECUJLV-UHFFFAOYSA-M |
Chemical Property Profile of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)
Property Insights of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)
The XLogP value of -2.57 indicates that Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 54.0 Ų, Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)?
The CAS number of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) is 70851-62-6.
What is the molecular formula of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)?
The molecular formula of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) is C10H11ClN2O2.
What is the molecular weight of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)?
The molecular weight of Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) is 226.0509 g/mol.
Where can I buy Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)?
You can request a quote for Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1)?
Yes, CoreyChem provides custom synthesis services for Pyridinium, 1-[2-[(2-cyanoacetyl)oxy]ethyl]-, chloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.