Vinyl decanoate
TL;DR: Vinyl decanoate (CAS 4704-31-8) is a chemical compound with molecular formula C12H22O2 and molecular weight 198.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl decanoate
Also Known As: Vinyl decanoate, ethenyl decanoate, vinyl caprate, Vinyl n-decanoate, vinyldecanoate
| Molecular Formula | C12H22O2 |
|---|---|
| Molecular Weight | 198.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 10 |
| Exact Mass | 198.16199 |
| Heavy Atoms | 14 |
| Complexity | 152.0 |
Chemical Identifiers
| CAS Number | 4704-31-8 |
|---|---|
| SMILES | CCCCCCCCCC(=O)OC=C |
| InChIKey | CMDXMIHZUJPRHG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vinyl decanoate (CAS 4704-31-8), with molecular formula C12H22O2 and molecular weight 198.16 g/mol. IUPAC: ethenyl decanoate.
Chemical Property Profile of Vinyl decanoate
Property Insights of Vinyl decanoate
The XLogP value of 4.7 indicates that Vinyl decanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Vinyl decanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vinyl decanoate 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 decanoate?
The CAS number of Vinyl decanoate is 4704-31-8.
What is the molecular formula of Vinyl decanoate?
The molecular formula of Vinyl decanoate is C12H22O2.
What is the molecular weight of Vinyl decanoate?
The molecular weight of Vinyl decanoate is 198.16 g/mol.
Where can I buy Vinyl decanoate?
You can request a quote for Vinyl decanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vinyl decanoate?
Yes, KEHONG BIO provides custom synthesis services for Vinyl decanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.