2-乙酰基吡啶
TL;DR: 2-乙酰基吡啶 (CAS 1122-62-9) is a chemical compound with molecular formula C7H7NO and molecular weight 121.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-乙酰基吡啶
1-pyridin-2-ylethanone
Also Known As: 2-ACETYLPYRIDINE, 1-(pyridin-2-yl)ethanone, Acetylpyridine, Methyl 2-pyridyl ketone, 1-pyridin-2-ylethanone
| Molecular Formula | C7H7NO |
|---|---|
| Molecular Weight | 121.05 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 121.052765 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
| Boiling Point | 189.00 to 193.00 °C. @ 760.00 mm Hg |
| Density | 1.077-1.084 |
| Solubility | Soluble in ether and acids |
| Vapor Pressure | 0.37 [mmHg] |
| Refractive Index | 1.518-1.524 |
Chemical Identifiers
| CAS Number | 1122-62-9 |
|---|---|
| SMILES | CC(=O)C1=CC=CC=N1 |
| InChIKey | AJKVQEKCUACUMD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙酰基吡啶 (CAS 1122-62-9), with molecular formula C7H7NO and molecular weight 121.05 g/mol. IUPAC: 1-pyridin-2-ylethanone.
Chemical Property Profile of 2-乙酰基吡啶
Property Insights of 2-乙酰基吡啶
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-乙酰基吡啶. With a topological polar surface area (TPSA) of 30.0 Ų, 2-乙酰基吡啶 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-乙酰基吡啶 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 2-乙酰基吡啶?
The CAS number of 2-乙酰基吡啶 is 1122-62-9.
What is the molecular formula of 2-乙酰基吡啶?
The molecular formula of 2-乙酰基吡啶 is C7H7NO.
What is the molecular weight of 2-乙酰基吡啶?
The molecular weight of 2-乙酰基吡啶 is 121.05 g/mol.
Where can I buy 2-乙酰基吡啶?
You can request a quote for 2-乙酰基吡啶 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙酰基吡啶?
Yes, KEHONG BIO provides custom synthesis services for 2-乙酰基吡啶 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.