吡啶-2-醛肟乙磺酸盐
TL;DR: 吡啶-2-醛肟乙磺酸盐 (CAS 63680-94-4) is a chemical compound with molecular formula C8H12N2O4S and molecular weight 232.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
吡啶-2-醛肟乙磺酸盐
ethanesulfonic acid;N-(pyridin-2-ylmethylidene)hydroxylamine
Also Known As: 2-Pam sulfonate, Pyridine-2-aldoxime ethanesulfonate, RefChem:1097307
| Molecular Formula | C8H12N2O4S |
|---|---|
| Molecular Weight | 232.05 g/mol |
| LogP | 0.78 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.05177 |
| Heavy Atoms | 15 |
| Complexity | 208.0 |
Chemical Identifiers
| CAS Number | 63680-94-4 |
|---|---|
| SMILES | CCS(=O)(=O)O.C1=CC=NC(=C1)C=NO |
| InChIKey | PPDKJQKBXSXZST-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
吡啶-2-醛肟乙磺酸盐 (CAS 63680-94-4), with molecular formula C8H12N2O4S and molecular weight 232.05 g/mol. IUPAC: ethanesulfonic acid;N-(pyridin-2-ylmethylidene)hydroxylamine.
Chemical Property Profile of 吡啶-2-醛肟乙磺酸盐
Property Insights of 吡啶-2-醛肟乙磺酸盐
The XLogP value of 0.78 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 吡啶-2-醛肟乙磺酸盐. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 吡啶-2-醛肟乙磺酸盐. Following Lipinski's Rule of Five, 吡啶-2-醛肟乙磺酸盐 has 2 hydrogen bond donor(s) and 6 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 吡啶-2-醛肟乙磺酸盐?
The CAS number of 吡啶-2-醛肟乙磺酸盐 is 63680-94-4.
What is the molecular formula of 吡啶-2-醛肟乙磺酸盐?
The molecular formula of 吡啶-2-醛肟乙磺酸盐 is C8H12N2O4S.
What is the molecular weight of 吡啶-2-醛肟乙磺酸盐?
The molecular weight of 吡啶-2-醛肟乙磺酸盐 is 232.05 g/mol.
Where can I buy 吡啶-2-醛肟乙磺酸盐?
You can request a quote for 吡啶-2-醛肟乙磺酸盐 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 吡啶-2-醛肟乙磺酸盐?
Yes, KEHONG BIO provides custom synthesis services for 吡啶-2-醛肟乙磺酸盐 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.