4-甲氧基吡啶N-氧化物
TL;DR: 4-甲氧基吡啶N-氧化物 (CAS 1122-96-9) is a chemical compound with molecular formula C6H7NO2 and molecular weight 125.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-甲氧基吡啶N-氧化物
4-methoxy-1-oxidopyridin-1-ium
Also Known As: 4-Methoxypyridine N-oxide, 4-Methoxypyridine 1-oxide, 4-Methoxypyridine-N-oxide, null, 4-Methoxypyridine N-oxide hydrate
| Molecular Formula | C6H7NO2 |
|---|---|
| Molecular Weight | 125.05 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 34.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 125.047676 |
| Heavy Atoms | 9 |
| Complexity | 79.0 |
Chemical Identifiers
| CAS Number | 1122-96-9 |
|---|---|
| SMILES | COC1=CC=[N+](C=C1)[O-] |
| InChIKey | BOFAIBPJCWFJFT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-甲氧基吡啶N-氧化物 (CAS 1122-96-9), with molecular formula C6H7NO2 and molecular weight 125.05 g/mol. IUPAC: 4-methoxy-1-oxidopyridin-1-ium.
Chemical Property Profile of 4-甲氧基吡啶N-氧化物
Property Insights of 4-甲氧基吡啶N-氧化物
The XLogP value of -0.7 indicates that 4-甲氧基吡啶N-氧化物 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.7 Ų, 4-甲氧基吡啶N-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-甲氧基吡啶N-氧化物 has 0 hydrogen bond donor(s) and 2 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 4-甲氧基吡啶N-氧化物?
The CAS number of 4-甲氧基吡啶N-氧化物 is 1122-96-9.
What is the molecular formula of 4-甲氧基吡啶N-氧化物?
The molecular formula of 4-甲氧基吡啶N-氧化物 is C6H7NO2.
What is the molecular weight of 4-甲氧基吡啶N-氧化物?
The molecular weight of 4-甲氧基吡啶N-氧化物 is 125.05 g/mol.
Where can I buy 4-甲氧基吡啶N-氧化物?
You can request a quote for 4-甲氧基吡啶N-氧化物 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-甲氧基吡啶N-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-甲氧基吡啶N-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.