5-Methylfurfuryl acetate
TL;DR: 5-Methylfurfuryl acetate (CAS 18091-24-2) is a chemical compound with molecular formula C8H10O3 and molecular weight 154.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(5-methylfuran-2-yl)methyl acetate
Also Known As: 5-Methylfurfuryl acetate, (5-methylfuran-2-yl)methyl acetate, 5-METHYLFURFURYLACETATE, 2-Methyl-5-(acetoxymethyl)furan, 5-Methyl-2-furanmethanol acetate
| Molecular Formula | C8H10O3 |
|---|---|
| Molecular Weight | 154.06 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 154.06299 |
| Heavy Atoms | 11 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 18091-24-2 |
|---|---|
| SMILES | CC1=CC=C(O1)COC(=O)C |
| InChIKey | WCAYUXKMYBPHIN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Methylfurfuryl acetate (CAS 18091-24-2), with molecular formula C8H10O3 and molecular weight 154.06 g/mol. IUPAC: (5-methylfuran-2-yl)methyl acetate.
Chemical Property Profile of 5-Methylfurfuryl acetate
Property Insights of 5-Methylfurfuryl acetate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Methylfurfuryl acetate. With a topological polar surface area (TPSA) of 39.4 Ų, 5-Methylfurfuryl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methylfurfuryl acetate has 0 hydrogen bond donor(s) and 3 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-Methylfurfuryl acetate?
The CAS number of 5-Methylfurfuryl acetate is 18091-24-2.
What is the molecular formula of 5-Methylfurfuryl acetate?
The molecular formula of 5-Methylfurfuryl acetate is C8H10O3.
What is the molecular weight of 5-Methylfurfuryl acetate?
The molecular weight of 5-Methylfurfuryl acetate is 154.06 g/mol.
Where can I buy 5-Methylfurfuryl acetate?
You can request a quote for 5-Methylfurfuryl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methylfurfuryl acetate?
Yes, KEHONG BIO provides custom synthesis services for 5-Methylfurfuryl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.