3-Furylmethyl acetate
TL;DR: 3-Furylmethyl acetate (CAS 30825-03-7) is a chemical compound with molecular formula C7H8O3 and molecular weight 140.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
furan-3-ylmethyl acetate
Also Known As: 3-Furylmethyl acetate, furan-3-ylmethyl acetate, 3-Furylmethylacetate, 3-Furanmethanol acetate, (furan-3-yl)methyl acetate
| Molecular Formula | C7H8O3 |
|---|---|
| Molecular Weight | 140.05 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 39.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 140.04735 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 30825-03-7 |
|---|---|
| SMILES | CC(=O)OCC1=COC=C1 |
| InChIKey | QJHHMZOFNNPSHQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Furylmethyl acetate (CAS 30825-03-7), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: furan-3-ylmethyl acetate.
Chemical Property Profile of 3-Furylmethyl acetate
Property Insights of 3-Furylmethyl acetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Furylmethyl acetate. With a topological polar surface area (TPSA) of 39.4 Ų, 3-Furylmethyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Furylmethyl 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 3-Furylmethyl acetate?
The CAS number of 3-Furylmethyl acetate is 30825-03-7.
What is the molecular formula of 3-Furylmethyl acetate?
The molecular formula of 3-Furylmethyl acetate is C7H8O3.
What is the molecular weight of 3-Furylmethyl acetate?
The molecular weight of 3-Furylmethyl acetate is 140.05 g/mol.
Where can I buy 3-Furylmethyl acetate?
You can request a quote for 3-Furylmethyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Furylmethyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-Furylmethyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.