3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one
TL;DR: 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one (CAS 141694-12-4) is a chemical compound with molecular formula C13H15NO2 and molecular weight 217.11028 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one
Also Known As: 4-ethoxy-1-(p-tolyl)-1H-pyrrol-2(5H)-one, 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one, AO-435/41051554, 2H-Pyrrol-2-one,4-ethoxy-1,5-dihydro-1-(4-methylphenyl)-(9CI), 4-ethoxy-1-(4-methylphenyl)-1,5-dihydro-2H-pyrrol-2-one
Technical Specifications
| Molecular Formula | C13H15NO2 |
| Molecular Weight | 217.11028 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 217.11028 Da |
| Heavy Atoms | 16 |
| Complexity | 290.0 |
| SMILES | CCOC1=CC(=O)N(C1)C2=CC=C(C=C2)C |
| InChIKey | AUTQNRQIXSHISE-UHFFFAOYSA-N |
Chemical Property Profile of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one
Property Insights of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one. With a topological polar surface area (TPSA) of 29.5 Ų, 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one 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
What is the CAS number of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one?
The CAS number of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one is 141694-12-4.
What is the molecular formula of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one?
The molecular formula of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one is C13H15NO2.
What is the molecular weight of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one?
The molecular weight of 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one is 217.11028 g/mol.
Where can I buy 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one?
You can request a quote for 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one?
Yes, CoreyChem provides custom synthesis services for 3-ethoxy-1-(4-methylphenyl)-2H-pyrrol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.