2-Pentylfuran
TL;DR: 2-Pentylfuran (CAS 3777-69-3) is a chemical compound with molecular formula C9H14O and molecular weight 138.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-pentylfuran
Also Known As: 2-PENTYLFURAN, 2-Amylfuran, 2-n-Pentylfuran, Furan, 2-pentyl-, Furan, pentyl-
| Molecular Formula | C9H14O |
|---|---|
| Molecular Weight | 138.10 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 13.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 138.10446 |
| Heavy Atoms | 10 |
| Complexity | 80.0 |
| Boiling Point | 64.00 to 66.00 °C. @ 23.00 mm Hg |
| Density | 0.886-0.893 |
| Solubility | very slightly |
| Refractive Index | 1.445-1.451 |
Chemical Identifiers
| CAS Number | 3777-69-3 |
|---|---|
| SMILES | CCCCCC1=CC=CO1 |
| InChIKey | YVBAUDVGOFCUSG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Pentylfuran (CAS 3777-69-3), with molecular formula C9H14O and molecular weight 138.10 g/mol. IUPAC: 2-pentylfuran.
Chemical Property Profile of 2-Pentylfuran
Property Insights of 2-Pentylfuran
The XLogP value of 3.7 indicates that 2-Pentylfuran is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 13.1 Ų, 2-Pentylfuran exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pentylfuran 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 2-Pentylfuran?
The CAS number of 2-Pentylfuran is 3777-69-3.
What is the molecular formula of 2-Pentylfuran?
The molecular formula of 2-Pentylfuran is C9H14O.
What is the molecular weight of 2-Pentylfuran?
The molecular weight of 2-Pentylfuran is 138.10 g/mol.
Where can I buy 2-Pentylfuran?
You can request a quote for 2-Pentylfuran directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pentylfuran?
Yes, KEHONG BIO provides custom synthesis services for 2-Pentylfuran and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.