5-Octyl-2(5H)-furanone
TL;DR: 5-Octyl-2(5H)-furanone (CAS 17756-68-2) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-octyl-2H-furan-5-one
Also Known As: 5-Octylfuran-2(5H)-one, 2-octyl-2H-furan-5-one, 5-octyl-2(5H)-furanone, 2(5H)-Furanone, 5-octyl-, 5-octyl-5H-furan-2-one
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 196.0 |
Chemical Identifiers
| CAS Number | 17756-68-2 |
|---|---|
| SMILES | CCCCCCCCC1C=CC(=O)O1 |
| InChIKey | BWXCHUAWFSHXMU-UHFFFAOYSA-N |
Product Overview
5-Octyl-2(5H)-furanone (CAS 17756-68-2), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 2-octyl-2H-furan-5-one.
Chemical Property Profile of 5-Octyl-2(5H)-furanone
Property Insights of 5-Octyl-2(5H)-furanone
The XLogP value of 4.2 indicates that 5-Octyl-2(5H)-furanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Octyl-2(5H)-furanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Octyl-2(5H)-furanone 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
Frequently Asked Questions
What is the CAS number of 5-Octyl-2(5H)-furanone?
The CAS number of 5-Octyl-2(5H)-furanone is 17756-68-2.
What is the molecular formula of 5-Octyl-2(5H)-furanone?
The molecular formula of 5-Octyl-2(5H)-furanone is C12H20O2.
What is the molecular weight of 5-Octyl-2(5H)-furanone?
The molecular weight of 5-Octyl-2(5H)-furanone is 196.15 g/mol.
Where can I buy 5-Octyl-2(5H)-furanone?
You can request a quote for 5-Octyl-2(5H)-furanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Octyl-2(5H)-furanone?
Yes, KEHONG BIO provides custom synthesis services for 5-Octyl-2(5H)-furanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.