Ethenyl but-2-enoate
TL;DR: Ethenyl but-2-enoate (CAS 14861-06-4) is a chemical compound with molecular formula C6H8O2 and molecular weight 112.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl but-2-enoate
Also Known As: Vinyl crotonate, Maletamere, ethenyl but-2-enoate, Vinyl But-2-enoate, ethenyl 2-butenoate
| Molecular Formula | C6H8O2 |
|---|---|
| Molecular Weight | 112.05 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.05243 |
| Heavy Atoms | 8 |
| Complexity | 114.0 |
Chemical Identifiers
| CAS Number | 14861-06-4 |
|---|---|
| SMILES | CC=CC(=O)OC=C |
| InChIKey | IYNRVIKPUTZSOR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethenyl but-2-enoate (CAS 14861-06-4), with molecular formula C6H8O2 and molecular weight 112.05 g/mol. IUPAC: ethenyl but-2-enoate.
Chemical Property Profile of Ethenyl but-2-enoate
Property Insights of Ethenyl but-2-enoate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethenyl but-2-enoate. With a topological polar surface area (TPSA) of 26.3 Ų, Ethenyl but-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethenyl but-2-enoate 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 Ethenyl but-2-enoate?
The CAS number of Ethenyl but-2-enoate is 14861-06-4.
What is the molecular formula of Ethenyl but-2-enoate?
The molecular formula of Ethenyl but-2-enoate is C6H8O2.
What is the molecular weight of Ethenyl but-2-enoate?
The molecular weight of Ethenyl but-2-enoate is 112.05 g/mol.
Where can I buy Ethenyl but-2-enoate?
You can request a quote for Ethenyl but-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethenyl but-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for Ethenyl but-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.