1-(4-ethyl-1H-pyrrol-3-yl)ethanone
TL;DR: 1-(4-ethyl-1H-pyrrol-3-yl)ethanone (CAS 64276-60-4) is a chemical compound with molecular formula C8H11NO and molecular weight 137.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-ethyl-1H-pyrrol-3-yl)ethanone
Also Known As: Ethanone,1- -, 1-(4-ethyl-1H-pyrrol-3-yl)ethanone, 1-(4-ethyl-1H-pyrrol-3-yl)ethan-1-one, Ethanone, 1-(4-ethyl-1H-pyrrol-3-yl)-, 1-(4-ETHYL-1H-PYRROL-3-YL)-ETHANONE
| Molecular Formula | C8H11NO |
|---|---|
| Molecular Weight | 137.08 g/mol |
| LogP | 1.7797 |
| Topological Polar Surface Area | 32.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 137.08406 |
| Heavy Atoms | 10 |
| Complexity | 237.16055 |
Chemical Identifiers
| CAS Number | 64276-60-4 |
|---|---|
| SMILES | CCC1=CNC=C1C(=O)C |
Product Overview
1-(4-ethyl-1H-pyrrol-3-yl)ethanone (CAS 64276-60-4), with molecular formula C8H11NO and molecular weight 137.08 g/mol. IUPAC: 1-(4-ethyl-1H-pyrrol-3-yl)ethanone.
Chemical Property Profile of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone
Property Insights of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone
The XLogP value of 1.7797 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-ethyl-1H-pyrrol-3-yl)ethanone. With a topological polar surface area (TPSA) of 32.86 Ų, 1-(4-ethyl-1H-pyrrol-3-yl)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-ethyl-1H-pyrrol-3-yl)ethanone 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 1-(4-ethyl-1H-pyrrol-3-yl)ethanone?
The CAS number of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone is 64276-60-4.
What is the molecular formula of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone?
The molecular formula of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone is C8H11NO.
What is the molecular weight of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone?
The molecular weight of 1-(4-ethyl-1H-pyrrol-3-yl)ethanone is 137.08 g/mol.
Where can I buy 1-(4-ethyl-1H-pyrrol-3-yl)ethanone?
You can request a quote for 1-(4-ethyl-1H-pyrrol-3-yl)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-ethyl-1H-pyrrol-3-yl)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-ethyl-1H-pyrrol-3-yl)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.