2,4Dimethyl-3-acetyl-5-isopropyl pyrrole
TL;DR: 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole (CAS 10280-94-1) is a chemical compound with molecular formula C11H17NO and molecular weight 179.13101 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(2,4-dimethyl-5-propan-2-yl-1H-pyrrol-3-yl)ethanone
Also Known As: 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole, 2,4-Dimethyl-3-acetyl-5-isopropyl-pyrrole, 1-(5-isopropyl-2,4-dimethyl-pyrrol-3-yl)-ethanone, 1-(2,4-dimethyl-5-propan-2-yl-1H-pyrrol-3-yl)ethanone
Technical Specifications
| Molecular Formula | C11H17NO |
| Molecular Weight | 179.13101 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 179.13101 Da |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
| SMILES | CC1=C(NC(=C1C(=O)C)C)C(C)C |
| InChIKey | UJWCMBRFXYGICF-UHFFFAOYSA-N |
Chemical Property Profile of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole
Property Insights of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole. With a topological polar surface area (TPSA) of 32.9 Ų, 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole?
The CAS number of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole is 10280-94-1.
What is the molecular formula of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole?
The molecular formula of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole is C11H17NO.
What is the molecular weight of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole?
The molecular weight of 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole is 179.13101 g/mol.
Where can I buy 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole?
You can request a quote for 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole?
Yes, CoreyChem provides custom synthesis services for 2,4Dimethyl-3-acetyl-5-isopropyl pyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.