2-Butanone, 4-hydroxy-4-(4-pyridinyl)-
TL;DR: 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- (CAS 106012-19-5) is a chemical compound with molecular formula C9H11NO2 and molecular weight 165.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-hydroxy-4-pyridin-4-ylbutan-2-one
Also Known As: 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-, 4-hydroxy-4-pyridin-4-ylbutan-2-one, Pentanenitrile,4-hydroxy-2-methylene, 4-hydroxy-4-(pyridin-4-yl)butan-2-one, 4-Hydroxy-4-(4-pyridyl)butane-2-one
Technical Specifications
| Molecular Formula | C9H11NO2 |
| Molecular Weight | 165.07898 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 50.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 165.07898 Da |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
| SMILES | CC(=O)CC(C1=CC=NC=C1)O |
| InChIKey | TVUXQVOEAFYAJC-UHFFFAOYSA-N |
Chemical Property Profile of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-
Property Insights of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-
The XLogP value of -0.3 indicates that 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 50.2 Ų, 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-?
The CAS number of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- is 106012-19-5.
What is the molecular formula of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-?
The molecular formula of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- is C9H11NO2.
What is the molecular weight of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-?
The molecular weight of 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- is 165.07898 g/mol.
Where can I buy 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-?
You can request a quote for 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Butanone, 4-hydroxy-4-(4-pyridinyl)-?
Yes, CoreyChem provides custom synthesis services for 2-Butanone, 4-hydroxy-4-(4-pyridinyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.