![4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one structure](/static/products/134/134162-82-6.webp)
4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one
TL;DR: 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one (CAS 134162-82-6) is a chemical compound with molecular formula C12H13NO2 and molecular weight 203.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one
Also Known As: 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one, 4-(2-(3-pyridinyl)ethenyl)tetrahydro-2H-pyran-2-one
Technical Specifications
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.09464 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 39.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 203.09464 Da |
| Heavy Atoms | 15 |
| Complexity | 250.0 |
| SMILES | C1COC(=O)CC1/C=C/C2=CN=CC=C2 |
| InChIKey | NWNQDWPLCLAVHH-ONEGZZNKSA-N |
Chemical Property Profile of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one
Property Insights of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one. With a topological polar surface area (TPSA) of 39.2 Ų, 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one has 0 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 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one?
The CAS number of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one is 134162-82-6.
What is the molecular formula of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one?
The molecular formula of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one is C12H13NO2.
What is the molecular weight of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one?
The molecular weight of 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one is 203.09464 g/mol.
Where can I buy 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one?
You can request a quote for 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one?
Yes, CoreyChem provides custom synthesis services for 4-[(E)-2-pyridin-3-ylethenyl]oxan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.