Furfural acetate
TL;DR: Furfural acetate (CAS 623-17-6) 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-2-ylmethyl acetate
Also Known As: Furfuryl acetate, furan-2-ylmethyl acetate, 2-Furanmethanol, acetate, 2-Furanmethanol acetate, FURFURAL 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 |
| Boiling Point | 347 to 177.2 °C at 760 mmHg |
| Density | 1.1175 at 20.0 °C |
| Solubility | 5 to 10 mg/mL at 73 °F (NTP, 1992) |
| Flash Point | 65.6 °C |
| Vapor Pressure | 1 mmHg at 57.8 °C ; 8.0 mmHg at 72.8 °C; 31.0 mmHg at 97.2 °C |
| Refractive Index | 1.457-1.466 |
Chemical Identifiers
| CAS Number | 623-17-6 |
|---|---|
| SMILES | CC(=O)OCC1=CC=CO1 |
| InChIKey | CKOYRRWBOKMNRG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Furfural acetate (CAS 623-17-6), with molecular formula C7H8O3 and molecular weight 140.05 g/mol. IUPAC: furan-2-ylmethyl acetate.
Chemical Property Profile of Furfural acetate
Property Insights of Furfural acetate
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Furfural acetate. With a topological polar surface area (TPSA) of 39.4 Ų, Furfural acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Furfural 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 Furfural acetate?
The CAS number of Furfural acetate is 623-17-6.
What is the molecular formula of Furfural acetate?
The molecular formula of Furfural acetate is C7H8O3.
What is the molecular weight of Furfural acetate?
The molecular weight of Furfural acetate is 140.05 g/mol.
Where can I buy Furfural acetate?
You can request a quote for Furfural acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Furfural acetate?
Yes, KEHONG BIO provides custom synthesis services for Furfural acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.