4-Acetyl-2-isopropenylpyridine
TL;DR: 4-Acetyl-2-isopropenylpyridine (CAS 14331-27-2) is a chemical compound with molecular formula C10H11NO and molecular weight 161.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-prop-1-en-2-yl-4-pyridinyl)ethanone
Also Known As: 4-acetyl-2-isopropenylpyridine, FEMA No. 4637, 1-(2-(Prop-1-en-2-yl)pyridin-4-yl)ethanone, 1-(2-prop-1-en-2-ylpyridin-4-yl)ethanone, 4-acetyl-2-isopropenyl pyridine
| Molecular Formula | C10H11NO |
|---|---|
| Molecular Weight | 161.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.08406 |
| Heavy Atoms | 12 |
| Complexity | 198.0 |
Chemical Identifiers
| CAS Number | 14331-27-2 |
|---|---|
| SMILES | CC(=C)C1=NC=CC(=C1)C(=O)C |
| InChIKey | RYNRLVOZUDLPQK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Acetyl-2-isopropenylpyridine (CAS 14331-27-2), with molecular formula C10H11NO and molecular weight 161.08 g/mol. IUPAC: 1-(2-prop-1-en-2-yl-4-pyridinyl)ethanone.
Chemical Property Profile of 4-Acetyl-2-isopropenylpyridine
Property Insights of 4-Acetyl-2-isopropenylpyridine
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Acetyl-2-isopropenylpyridine. With a topological polar surface area (TPSA) of 30.0 Ų, 4-Acetyl-2-isopropenylpyridine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Acetyl-2-isopropenylpyridine 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-Acetyl-2-isopropenylpyridine?
The CAS number of 4-Acetyl-2-isopropenylpyridine is 14331-27-2.
What is the molecular formula of 4-Acetyl-2-isopropenylpyridine?
The molecular formula of 4-Acetyl-2-isopropenylpyridine is C10H11NO.
What is the molecular weight of 4-Acetyl-2-isopropenylpyridine?
The molecular weight of 4-Acetyl-2-isopropenylpyridine is 161.08 g/mol.
Where can I buy 4-Acetyl-2-isopropenylpyridine?
You can request a quote for 4-Acetyl-2-isopropenylpyridine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Acetyl-2-isopropenylpyridine?
Yes, KEHONG BIO provides custom synthesis services for 4-Acetyl-2-isopropenylpyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.