2-Propionylpyrroline
TL;DR: 2-Propionylpyrroline (CAS 133762-95-5) is a chemical compound with molecular formula C7H11NO and molecular weight 125.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(3,4-dihydro-2H-pyrrol-5-yl)propan-1-one
Also Known As: 2-propionyl-1-pyrroline, 2-Propionylpyrroline, 1-(3,4-dihydro-2H-pyrrol-5-yl)propan-1-one, Discontinued", FEMA No. 4063
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H11NO |
| Molecular Weight | 125.08406 g/mol |
| XLogP | 0.0 |
| Topological Polar Surface Area (TPSA) | 29.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 125.08406 Da |
| Heavy Atoms | 9 |
| Complexity | 149.0 |
| SMILES | CCC(=O)C1=NCCC1 |
| InChIKey | OVNCGQSYSSYBPO-UHFFFAOYSA-N |
Chemical Property Profile of 2-Propionylpyrroline
Property Insights of 2-Propionylpyrroline
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propionylpyrroline. With a topological polar surface area (TPSA) of 29.4 Ų, 2-Propionylpyrroline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propionylpyrroline 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 2-Propionylpyrroline?
The CAS number of 2-Propionylpyrroline is 133762-95-5.
What is the molecular formula of 2-Propionylpyrroline?
The molecular formula of 2-Propionylpyrroline is C7H11NO.
What is the molecular weight of 2-Propionylpyrroline?
The molecular weight of 2-Propionylpyrroline is 125.08406 g/mol.
Where can I buy 2-Propionylpyrroline?
You can request a quote for 2-Propionylpyrroline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Propionylpyrroline?
Yes, CoreyChem provides custom synthesis services for 2-Propionylpyrroline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.