Vinyl hexanoate
TL;DR: Vinyl hexanoate (CAS 3050-69-9) is a chemical compound with molecular formula C8H14O2 and molecular weight 142.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl hexanoate
Also Known As: Vinyl hexanoate, Vinyl caproate, ethenyl hexanoate, vinylhexanoate, Vinyl hexoate
| Molecular Formula | C8H14O2 |
|---|---|
| Molecular Weight | 142.10 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 142.09938 |
| Heavy Atoms | 10 |
| Complexity | 108.0 |
Chemical Identifiers
| CAS Number | 3050-69-9 |
|---|---|
| SMILES | CCCCCC(=O)OC=C |
| InChIKey | LZWYWAIOTBEZFN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vinyl hexanoate (CAS 3050-69-9), with molecular formula C8H14O2 and molecular weight 142.10 g/mol. IUPAC: ethenyl hexanoate.
Chemical Property Profile of Vinyl hexanoate
Property Insights of Vinyl hexanoate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vinyl hexanoate. With a topological polar surface area (TPSA) of 26.3 Ų, Vinyl hexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vinyl hexanoate 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 Vinyl hexanoate?
The CAS number of Vinyl hexanoate is 3050-69-9.
What is the molecular formula of Vinyl hexanoate?
The molecular formula of Vinyl hexanoate is C8H14O2.
What is the molecular weight of Vinyl hexanoate?
The molecular weight of Vinyl hexanoate is 142.10 g/mol.
Where can I buy Vinyl hexanoate?
You can request a quote for Vinyl hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vinyl hexanoate?
Yes, KEHONG BIO provides custom synthesis services for Vinyl hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.