S-oct-7-enyl ethanethioate
TL;DR: S-oct-7-enyl ethanethioate (CAS 32438-29-2) is a chemical compound with molecular formula C10H18OS and molecular weight 186.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-oct-7-enyl ethanethioate
Also Known As: S- ethanethioate, 7-Octenylthioacetat, S-oct-7-enyl ethanethioate, 7-Octenethiol, acetate, S-(7-Octenyl) ethanethioate #
| Molecular Formula | C10H18OS |
|---|---|
| Molecular Weight | 186.11 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 186.10783 |
| Heavy Atoms | 12 |
| Complexity | 132.0 |
Chemical Identifiers
| CAS Number | 32438-29-2 |
|---|---|
| SMILES | CC(=O)SCCCCCCC=C |
| InChIKey | DHYMGRCNISTYRP-UHFFFAOYSA-N |
Product Overview
S-oct-7-enyl ethanethioate (CAS 32438-29-2), with molecular formula C10H18OS and molecular weight 186.11 g/mol. IUPAC: S-oct-7-enyl ethanethioate.
Chemical Property Profile of S-oct-7-enyl ethanethioate
Property Insights of S-oct-7-enyl ethanethioate
The XLogP value of 3.6 indicates that S-oct-7-enyl ethanethioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.4 Ų, S-oct-7-enyl ethanethioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-oct-7-enyl ethanethioate 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 S-oct-7-enyl ethanethioate?
The CAS number of S-oct-7-enyl ethanethioate is 32438-29-2.
What is the molecular formula of S-oct-7-enyl ethanethioate?
The molecular formula of S-oct-7-enyl ethanethioate is C10H18OS.
What is the molecular weight of S-oct-7-enyl ethanethioate?
The molecular weight of S-oct-7-enyl ethanethioate is 186.11 g/mol.
Where can I buy S-oct-7-enyl ethanethioate?
You can request a quote for S-oct-7-enyl ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-oct-7-enyl ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-oct-7-enyl ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.