Butyl vinyl ether
TL;DR: Butyl vinyl ether (CAS 111-34-2) is a chemical compound with molecular formula C6H12O and molecular weight 100.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethenoxybutane
Also Known As: n-Butyl vinyl ether, BUTYL VINYL ETHER, Vinyl butyl ether, Butoxyethene, Butoxyethylene
| Molecular Formula | C6H12O |
|---|---|
| Molecular Weight | 100.09 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 100.08881 |
| Heavy Atoms | 7 |
| Complexity | 41.0 |
| Melting Point | -92 °C |
| Boiling Point | 94 °C |
| Density | 0.7888 at 20 °C/20 °C |
| Solubility | Sol in alc and ether |
| Flash Point | -9.4 °C (NFPA, 2010) |
| Vapor Pressure | 49.1 [mmHg] |
| Refractive Index | 1.4026 at 20 °C |
Chemical Identifiers
| CAS Number | 111-34-2 |
|---|---|
| SMILES | CCCCOC=C |
| InChIKey | UZKWTJUDCOPSNM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Butyl vinyl ether (CAS 111-34-2), with molecular formula C6H12O and molecular weight 100.09 g/mol. IUPAC: 1-ethenoxybutane.
Chemical Property Profile of Butyl vinyl ether
Property Insights of Butyl vinyl ether
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl vinyl ether. With a topological polar surface area (TPSA) of 9.2 Ų, Butyl vinyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl vinyl ether has 0 hydrogen bond donor(s) and 1 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 Butyl vinyl ether?
The CAS number of Butyl vinyl ether is 111-34-2.
What is the molecular formula of Butyl vinyl ether?
The molecular formula of Butyl vinyl ether is C6H12O.
What is the molecular weight of Butyl vinyl ether?
The molecular weight of Butyl vinyl ether is 100.09 g/mol.
Where can I buy Butyl vinyl ether?
You can request a quote for Butyl vinyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Butyl vinyl ether?
Yes, KEHONG BIO provides custom synthesis services for Butyl vinyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.