乙酸乙烯酯
TL;DR: 乙酸乙烯酯 (CAS 108-05-4) is a chemical compound with molecular formula C4H6O2 and molecular weight 86.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
乙酸乙烯酯
ethenyl acetate
Also Known As: VINYL ACETATE, Ethenyl acetate, Acetoxyethylene, Vinylacetate, Acetoxyethene
| Molecular Formula | C4H6O2 |
|---|---|
| Molecular Weight | 86.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 86.03678 |
| Heavy Atoms | 6 |
| Complexity | 65.0 |
| Melting Point | -93.3 °C |
| Boiling Point | 162 to 72.8 °C at 760 mmHg |
| Density | 0.932 at 20.0 °C - Less dense than water; will float |
| Solubility | 2 % (NIOSH, 2024) |
| Flash Point | -7.8 °C |
| Vapor Pressure | 83 to 140 mmHg at 68 to 30.0 °C |
| Refractive Index | 1.3926 at 25 °C |
Chemical Identifiers
| CAS Number | 108-05-4 |
|---|---|
| SMILES | CC(=O)OC=C |
| InChIKey | XTXRWKRVRITETP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
乙酸乙烯酯 (CAS 108-05-4), with molecular formula C4H6O2 and molecular weight 86.04 g/mol. IUPAC: ethenyl acetate.
Chemical Property Profile of 乙酸乙烯酯
Property Insights of 乙酸乙烯酯
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 乙酸乙烯酯. With a topological polar surface area (TPSA) of 26.3 Ų, 乙酸乙烯酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 乙酸乙烯酯 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 乙酸乙烯酯?
The CAS number of 乙酸乙烯酯 is 108-05-4.
What is the molecular formula of 乙酸乙烯酯?
The molecular formula of 乙酸乙烯酯 is C4H6O2.
What is the molecular weight of 乙酸乙烯酯?
The molecular weight of 乙酸乙烯酯 is 86.04 g/mol.
Where can I buy 乙酸乙烯酯?
You can request a quote for 乙酸乙烯酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙酸乙烯酯?
Yes, KEHONG BIO provides custom synthesis services for 乙酸乙烯酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.