3-Acetylpyridine
TL;DR: 3-Acetylpyridine (CAS 350-03-8) 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.
1-pyridin-3-ylethanone
Also Known As: 3-ACETYLPYRIDINE, 1-(pyridin-3-yl)ethanone, 3-Acetopyridine, 1-pyridin-3-ylethanone, 1-(3-Pyridinyl)ethanone
| Molecular Formula | C7H7NO |
|---|---|
| Molecular Weight | 121.05 g/mol |
| LogP | 0.4 |
| 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 |
| Melting Point | 13.5 °C |
| Boiling Point | 228.00 to 230.00 °C. @ 760.00 mm Hg |
| Density | 1.103-1.112 |
| Solubility | Soluble in acids,alcohol, ether, and water |
| Refractive Index | 1.530-1.540 |
Chemical Identifiers
| CAS Number | 350-03-8 |
|---|---|
| SMILES | CC(=O)C1=CN=CC=C1 |
| InChIKey | WEGYGNROSJDEIW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Acetylpyridine (CAS 350-03-8), with molecular formula C7H7NO and molecular weight 121.05 g/mol. IUPAC: 1-pyridin-3-ylethanone.
Chemical Property Profile of 3-Acetylpyridine
Property Insights of 3-Acetylpyridine
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Acetylpyridine. With a topological polar surface area (TPSA) of 30.0 Ų, 3-Acetylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Acetylpyridine 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 3-Acetylpyridine?
The CAS number of 3-Acetylpyridine is 350-03-8.
What is the molecular formula of 3-Acetylpyridine?
The molecular formula of 3-Acetylpyridine is C7H7NO.
What is the molecular weight of 3-Acetylpyridine?
The molecular weight of 3-Acetylpyridine is 121.05 g/mol.
Where can I buy 3-Acetylpyridine?
You can request a quote for 3-Acetylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Acetylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 3-Acetylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.