5-Ethylidene-2(5H)-furanone
TL;DR: 5-Ethylidene-2(5H)-furanone (CAS 3690-50-4) is a chemical compound with molecular formula C6H6O2 and molecular weight 110.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-ethylidenefuran-2-one
Also Known As: 5-ethylidene-2(5H)-Furanone, 5-ethylidene-5H-furan-2-one, 5-Ethylidenefuran-2(5H)-one, 2(5H)-Furanone,5-ethylidene-, 5-ETHYLIDENEFURAN-2-ONE
| Molecular Formula | C6H6O2 |
|---|---|
| Molecular Weight | 110.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 110.03678 |
| Heavy Atoms | 8 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 3690-50-4 |
|---|---|
| SMILES | CC=C1C=CC(=O)O1 |
| InChIKey | UBTPQJCPHOHKMF-UHFFFAOYSA-N |
Product Overview
5-Ethylidene-2(5H)-furanone (CAS 3690-50-4), with molecular formula C6H6O2 and molecular weight 110.04 g/mol. IUPAC: 5-ethylidenefuran-2-one.
Chemical Property Profile of 5-Ethylidene-2(5H)-furanone
Property Insights of 5-Ethylidene-2(5H)-furanone
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethylidene-2(5H)-furanone. With a topological polar surface area (TPSA) of 26.3 Ų, 5-Ethylidene-2(5H)-furanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethylidene-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-Ethylidene-2(5H)-furanone?
The CAS number of 5-Ethylidene-2(5H)-furanone is 3690-50-4.
What is the molecular formula of 5-Ethylidene-2(5H)-furanone?
The molecular formula of 5-Ethylidene-2(5H)-furanone is C6H6O2.
What is the molecular weight of 5-Ethylidene-2(5H)-furanone?
The molecular weight of 5-Ethylidene-2(5H)-furanone is 110.04 g/mol.
Where can I buy 5-Ethylidene-2(5H)-furanone?
You can request a quote for 5-Ethylidene-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-Ethylidene-2(5H)-furanone?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethylidene-2(5H)-furanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.