2-Propionylpyrrole
TL;DR: 2-Propionylpyrrole (CAS 1073-26-3) is a chemical compound with molecular formula C7H9NO and molecular weight 123.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1H-pyrrol-2-yl)propan-1-one
Also Known As: 2-Propionylpyrrole, 1-(1H-Pyrrol-2-yl)propan-1-one, Ethyl 2-pyrrolyl ketone, 2-Pyrryl ethyl ketone, alpha-Propionylpyrrole
| Molecular Formula | C7H9NO |
|---|---|
| Molecular Weight | 123.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 32.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 123.06841 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
| Solubility | Slightly soluble in water; Insoluble in fats |
Chemical Identifiers
| CAS Number | 1073-26-3 |
|---|---|
| SMILES | CCC(=O)C1=CC=CN1 |
| InChIKey | AEJPPSRYXGEVDT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propionylpyrrole (CAS 1073-26-3), with molecular formula C7H9NO and molecular weight 123.07 g/mol. IUPAC: 1-(1H-pyrrol-2-yl)propan-1-one.
Chemical Property Profile of 2-Propionylpyrrole
Property Insights of 2-Propionylpyrrole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propionylpyrrole. With a topological polar surface area (TPSA) of 32.9 Ų, 2-Propionylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propionylpyrrole 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
Frequently Asked Questions
What is the CAS number of 2-Propionylpyrrole?
The CAS number of 2-Propionylpyrrole is 1073-26-3.
What is the molecular formula of 2-Propionylpyrrole?
The molecular formula of 2-Propionylpyrrole is C7H9NO.
What is the molecular weight of 2-Propionylpyrrole?
The molecular weight of 2-Propionylpyrrole is 123.07 g/mol.
Where can I buy 2-Propionylpyrrole?
You can request a quote for 2-Propionylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propionylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 2-Propionylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.