4-(叔丁基)吡啶 1-氧化物
TL;DR: 4-(叔丁基)吡啶 1-氧化物 (CAS 23569-17-7) is a chemical compound with molecular formula C9H13NO and molecular weight 151.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(叔丁基)吡啶 1-氧化物
4-tert-butyl-1-oxidopyridin-1-ium
Also Known As: 4-tert-Butylpyridine 1-oxide, 4-tert-butyl-1-oxypyridine, 4-t-butylpyridine N-oxide, 4-t-Butylpyridine-N-oxide, 4-(tert-Butyl)pyridine 1-Oxide
| Molecular Formula | C9H13NO |
|---|---|
| Molecular Weight | 151.10 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 25.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 151.09972 |
| Heavy Atoms | 11 |
| Complexity | 120.0 |
Chemical Identifiers
| CAS Number | 23569-17-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=[N+](C=C1)[O-] |
| InChIKey | CMFQXPIZAKBRCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(叔丁基)吡啶 1-氧化物 (CAS 23569-17-7), with molecular formula C9H13NO and molecular weight 151.10 g/mol. IUPAC: 4-tert-butyl-1-oxidopyridin-1-ium.
Chemical Property Profile of 4-(叔丁基)吡啶 1-氧化物
Property Insights of 4-(叔丁基)吡啶 1-氧化物
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(叔丁基)吡啶 1-氧化物. With a topological polar surface area (TPSA) of 25.5 Ų, 4-(叔丁基)吡啶 1-氧化物 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(叔丁基)吡啶 1-氧化物 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 4-(叔丁基)吡啶 1-氧化物?
The CAS number of 4-(叔丁基)吡啶 1-氧化物 is 23569-17-7.
What is the molecular formula of 4-(叔丁基)吡啶 1-氧化物?
The molecular formula of 4-(叔丁基)吡啶 1-氧化物 is C9H13NO.
What is the molecular weight of 4-(叔丁基)吡啶 1-氧化物?
The molecular weight of 4-(叔丁基)吡啶 1-氧化物 is 151.10 g/mol.
Where can I buy 4-(叔丁基)吡啶 1-氧化物?
You can request a quote for 4-(叔丁基)吡啶 1-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-(叔丁基)吡啶 1-氧化物?
Yes, KEHONG BIO provides custom synthesis services for 4-(叔丁基)吡啶 1-氧化物 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.