5-Acetoxymethyl-2-furaldehyde
TL;DR: 5-Acetoxymethyl-2-furaldehyde (CAS 10551-58-3) is a chemical compound with molecular formula C8H8O4 and molecular weight 168.04225 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(5-formylfuran-2-yl)methyl acetate
Also Known As: 5-Acetoxymethyl-2-furaldehyde, (5-formylfuran-2-yl)methyl acetate, 5-Formylfurfuryl acetate, 5-Acetoxymethylfurfural, null
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H8O4 |
| Molecular Weight | 168.04225 g/mol |
| XLogP | 0.5 |
| Topological Polar Surface Area (TPSA) | 56.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 168.04225 Da |
| Heavy Atoms | 12 |
| Complexity | 178.0 |
| SMILES | CC(=O)OCC1=CC=C(O1)C=O |
| InChIKey | QAVITTVTXPZTSE-UHFFFAOYSA-N |
Chemical Property Profile of 5-Acetoxymethyl-2-furaldehyde
Property Insights of 5-Acetoxymethyl-2-furaldehyde
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Acetoxymethyl-2-furaldehyde. With a topological polar surface area (TPSA) of 56.5 Ų, 5-Acetoxymethyl-2-furaldehyde exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Acetoxymethyl-2-furaldehyde has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5-Acetoxymethyl-2-furaldehyde?
The CAS number of 5-Acetoxymethyl-2-furaldehyde is 10551-58-3.
What is the molecular formula of 5-Acetoxymethyl-2-furaldehyde?
The molecular formula of 5-Acetoxymethyl-2-furaldehyde is C8H8O4.
What is the molecular weight of 5-Acetoxymethyl-2-furaldehyde?
The molecular weight of 5-Acetoxymethyl-2-furaldehyde is 168.04225 g/mol.
Where can I buy 5-Acetoxymethyl-2-furaldehyde?
You can request a quote for 5-Acetoxymethyl-2-furaldehyde directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5-Acetoxymethyl-2-furaldehyde?
Yes, CoreyChem provides custom synthesis services for 5-Acetoxymethyl-2-furaldehyde and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.