N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide
TL;DR: N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide (CAS 1137-97-9) 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.
N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide
Also Known As: N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide, N-(1-Methyl-3-oxo-3-phenyl-1-propen-1-yl)acetamide
Technical Specifications
| Molecular Formula | C12H13NO2 |
| Molecular Weight | 203.09464 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 46.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 203.09464 Da |
| Heavy Atoms | 15 |
| Complexity | 275.0 |
| SMILES | CC(=CC(=O)C1=CC=CC=C1)NC(=O)C |
| InChIKey | LIXULBRIODGJKN-UHFFFAOYSA-N |
Chemical Property Profile of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide
Property Insights of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide. With a topological polar surface area (TPSA) of 46.2 Ų, N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide?
The CAS number of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide is 1137-97-9.
What is the molecular formula of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide?
The molecular formula of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide is C12H13NO2.
What is the molecular weight of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide?
The molecular weight of N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide is 203.09464 g/mol.
Where can I buy N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide?
You can request a quote for N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide?
Yes, CoreyChem provides custom synthesis services for N-(4-oxo-4-phenylbut-2-en-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.