1-Furfurylpyrrole
TL;DR: 1-Furfurylpyrrole (CAS 1438-94-4) is a chemical compound with molecular formula C9H9NO and molecular weight 147.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(furan-2-ylmethyl)pyrrole
Also Known As: 1-FURFURYLPYRROLE, N-Furfurylpyrrole, 1-(Furan-2-ylmethyl)-1H-pyrrole, N-Furfuryl pyrrole, 1-Furfuryl-1H-pyrrole
| Molecular Formula | C9H9NO |
|---|---|
| Molecular Weight | 147.07 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 147.06842 |
| Heavy Atoms | 11 |
| Complexity | 121.0 |
| Boiling Point | 77.00 to 79.00 °C. @ 1.00 mm Hg |
| Density | 1.078-1.084 |
| Solubility | Soluble (in ethanol) |
| Refractive Index | 1.529-1.536 |
Chemical Identifiers
| CAS Number | 1438-94-4 |
|---|---|
| SMILES | C1=CN(C=C1)CC2=CC=CO2 |
| InChIKey | BTBFUBUCCJKJOZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Furfurylpyrrole (CAS 1438-94-4), with molecular formula C9H9NO and molecular weight 147.07 g/mol. IUPAC: 1-(furan-2-ylmethyl)pyrrole.
Chemical Property Profile of 1-Furfurylpyrrole
Property Insights of 1-Furfurylpyrrole
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Furfurylpyrrole. With a topological polar surface area (TPSA) of 18.1 Ų, 1-Furfurylpyrrole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Furfurylpyrrole has 0 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-Furfurylpyrrole?
The CAS number of 1-Furfurylpyrrole is 1438-94-4.
What is the molecular formula of 1-Furfurylpyrrole?
The molecular formula of 1-Furfurylpyrrole is C9H9NO.
What is the molecular weight of 1-Furfurylpyrrole?
The molecular weight of 1-Furfurylpyrrole is 147.07 g/mol.
Where can I buy 1-Furfurylpyrrole?
You can request a quote for 1-Furfurylpyrrole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Furfurylpyrrole?
Yes, KEHONG BIO provides custom synthesis services for 1-Furfurylpyrrole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.