2-乙酰呋喃
TL;DR: 2-乙酰呋喃 (CAS 1192-62-7) 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.
2-乙酰呋喃
1-(furan-2-yl)ethanone
Also Known As: 2-Acetylfuran, Acetylfuran, 1-(furan-2-yl)ethanone, 2-Furyl methyl ketone, 2-Acetyl furan
| Molecular Formula | C6H6O2 |
|---|---|
| Molecular Weight | 110.04 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 30.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 110.03678 |
| Heavy Atoms | 8 |
| Complexity | 98.0 |
| Melting Point | 33 °C |
| Boiling Point | 67.00 °C. @ 10.00 mm Hg |
| Density | 1.102-1.107 |
| Solubility | Very slightly soluble in water; Slightly soluble in propylene glycol, vegetable oils |
| Refractive Index | 1.505-1.510 |
Chemical Identifiers
| CAS Number | 1192-62-7 |
|---|---|
| SMILES | CC(=O)C1=CC=CO1 |
| InChIKey | IEMMBWWQXVXBEU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-乙酰呋喃 (CAS 1192-62-7), with molecular formula C6H6O2 and molecular weight 110.04 g/mol. IUPAC: 1-(furan-2-yl)ethanone.
Chemical Property Profile of 2-乙酰呋喃
Property Insights of 2-乙酰呋喃
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-乙酰呋喃. With a topological polar surface area (TPSA) of 30.2 Ų, 2-乙酰呋喃 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-乙酰呋喃 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 2-乙酰呋喃?
The CAS number of 2-乙酰呋喃 is 1192-62-7.
What is the molecular formula of 2-乙酰呋喃?
The molecular formula of 2-乙酰呋喃 is C6H6O2.
What is the molecular weight of 2-乙酰呋喃?
The molecular weight of 2-乙酰呋喃 is 110.04 g/mol.
Where can I buy 2-乙酰呋喃?
You can request a quote for 2-乙酰呋喃 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-乙酰呋喃?
Yes, KEHONG BIO provides custom synthesis services for 2-乙酰呋喃 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.