S-tert-Butyl (trimethylsilyl)ethanethioate
TL;DR: S-tert-Butyl (trimethylsilyl)ethanethioate (CAS 63877-24-7) is a chemical compound with molecular formula C9H20OSSi and molecular weight 204.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
S-tert-butyl 2-trimethylsilylethanethioate
Also Known As: S-tert-Butyl (trimethylsilyl)ethanethioate, S-tert-butyl 2-trimethylsilylethanethioate
| Molecular Formula | C9H20OSSi |
|---|---|
| Molecular Weight | 204.10 g/mol |
| LogP | 3.3829 |
| Topological Polar Surface Area | 42.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 204.10042 |
| Heavy Atoms | 12 |
| Complexity | 164.0 |
Chemical Identifiers
| CAS Number | 63877-24-7 |
|---|---|
| SMILES | CC(C)(C)SC(=O)C[Si](C)(C)C |
| InChIKey | AHVMKODJXXSLEH-UHFFFAOYSA-N |
Product Overview
S-tert-Butyl (trimethylsilyl)ethanethioate (CAS 63877-24-7), with molecular formula C9H20OSSi and molecular weight 204.10 g/mol. IUPAC: S-tert-butyl 2-trimethylsilylethanethioate.
Chemical Property Profile of S-tert-Butyl (trimethylsilyl)ethanethioate
Property Insights of S-tert-Butyl (trimethylsilyl)ethanethioate
The XLogP value of 3.3829 indicates that S-tert-Butyl (trimethylsilyl)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-tert-Butyl (trimethylsilyl)ethanethioate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, S-tert-Butyl (trimethylsilyl)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-tert-Butyl (trimethylsilyl)ethanethioate?
The CAS number of S-tert-Butyl (trimethylsilyl)ethanethioate is 63877-24-7.
What is the molecular formula of S-tert-Butyl (trimethylsilyl)ethanethioate?
The molecular formula of S-tert-Butyl (trimethylsilyl)ethanethioate is C9H20OSSi.
What is the molecular weight of S-tert-Butyl (trimethylsilyl)ethanethioate?
The molecular weight of S-tert-Butyl (trimethylsilyl)ethanethioate is 204.10 g/mol.
Where can I buy S-tert-Butyl (trimethylsilyl)ethanethioate?
You can request a quote for S-tert-Butyl (trimethylsilyl)ethanethioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for S-tert-Butyl (trimethylsilyl)ethanethioate?
Yes, KEHONG BIO provides custom synthesis services for S-tert-Butyl (trimethylsilyl)ethanethioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.