1H-pyridin-1-ium-2-one chloride
TL;DR: 1H-pyridin-1-ium-2-one chloride (CAS 13472-62-3) is a chemical compound with molecular formula C5H6ClNO and molecular weight 131.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1H-pyridin-1-ium-2-one chloride
Also Known As: 2-Oxopyridinium chloride, EINECS 236-746-0
| Molecular Formula | C5H6ClNO |
|---|---|
| Molecular Weight | 131.01 g/mol |
| LogP | -3.8361 |
| Topological Polar Surface Area | 33.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 131.0138 |
| Heavy Atoms | 8 |
| Complexity | 139.36409 |
Chemical Identifiers
| CAS Number | 13472-62-3 |
|---|---|
| SMILES | C1=CC(=O)[NH2+]C=C1.[Cl-] |
Product Overview
1H-pyridin-1-ium-2-one chloride (CAS 13472-62-3), with molecular formula C5H6ClNO and molecular weight 131.01 g/mol. IUPAC: 1H-pyridin-1-ium-2-one chloride.
Chemical Property Profile of 1H-pyridin-1-ium-2-one chloride
Property Insights of 1H-pyridin-1-ium-2-one chloride
The XLogP value of -3.8361 indicates that 1H-pyridin-1-ium-2-one chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 33.68 Ų, 1H-pyridin-1-ium-2-one chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-pyridin-1-ium-2-one chloride has 1 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 1H-pyridin-1-ium-2-one chloride?
The CAS number of 1H-pyridin-1-ium-2-one chloride is 13472-62-3.
What is the molecular formula of 1H-pyridin-1-ium-2-one chloride?
The molecular formula of 1H-pyridin-1-ium-2-one chloride is C5H6ClNO.
What is the molecular weight of 1H-pyridin-1-ium-2-one chloride?
The molecular weight of 1H-pyridin-1-ium-2-one chloride is 131.01 g/mol.
Where can I buy 1H-pyridin-1-ium-2-one chloride?
You can request a quote for 1H-pyridin-1-ium-2-one chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-pyridin-1-ium-2-one chloride?
Yes, KEHONG BIO provides custom synthesis services for 1H-pyridin-1-ium-2-one chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.