Vinyl valerate
TL;DR: Vinyl valerate (CAS 5873-43-8) is a chemical compound with molecular formula C7H12O2 and molecular weight 128.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethenyl pentanoate
Also Known As: Vinyl valerate, ethenyl pentanoate, Vinyl pivalate, Vinylvalerate, VINYL n-VALERATE
| Molecular Formula | C7H12O2 |
|---|---|
| Molecular Weight | 128.08 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 128.08372 |
| Heavy Atoms | 9 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 5873-43-8 |
|---|---|
| SMILES | CCCCC(=O)OC=C |
| InChIKey | BLZSRIYYOIZLJL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Vinyl valerate (CAS 5873-43-8), with molecular formula C7H12O2 and molecular weight 128.08 g/mol. IUPAC: ethenyl pentanoate.
Chemical Property Profile of Vinyl valerate
Property Insights of Vinyl valerate
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Vinyl valerate. With a topological polar surface area (TPSA) of 26.3 Ų, Vinyl valerate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Vinyl valerate 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 valerate?
The CAS number of Vinyl valerate is 5873-43-8.
What is the molecular formula of Vinyl valerate?
The molecular formula of Vinyl valerate is C7H12O2.
What is the molecular weight of Vinyl valerate?
The molecular weight of Vinyl valerate is 128.08 g/mol.
Where can I buy Vinyl valerate?
You can request a quote for Vinyl valerate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Vinyl valerate?
Yes, KEHONG BIO provides custom synthesis services for Vinyl valerate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.