![Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) structure](/static/products/633/6334-91-4.png)
Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)
TL;DR: Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) (CAS 6334-91-4) is a chemical compound with molecular formula C13H28O2SSn and molecular weight 368.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(6-methylheptoxy)-2-oxoethanethiolate;trimethylstannanylium
Also Known As: Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI), ((Trimethylstannyl)thio)acetic acid isooctyl ester, trimethylstannanylium 2-[(6-methylheptyl)oxy]-2-oxoethanethiolate, 2-(6-methylheptoxy)-2-oxoethanethiolate; trimethylstannanylium
| Molecular Formula | C13H28O2SSn |
|---|---|
| Molecular Weight | 368.08 g/mol |
| LogP | 3.6635 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 368.0832 |
| Heavy Atoms | 17 |
| Complexity | 170.04752 |
Chemical Identifiers
| CAS Number | 6334-91-4 |
|---|---|
| SMILES | CC(C)CCCCCOC(=O)C[S-].C[Sn+](C)C |
Product Overview
Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) (CAS 6334-91-4), with molecular formula C13H28O2SSn and molecular weight 368.08 g/mol. IUPAC: 2-(6-methylheptoxy)-2-oxoethanethiolate;trimethylstannanylium.
Chemical Property Profile of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)
Property Insights of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)
The XLogP value of 3.6635 indicates that Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) has 0 hydrogen bond donor(s) and 3 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 Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)?
The CAS number of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) is 6334-91-4.
What is the molecular formula of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)?
The molecular formula of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) is C13H28O2SSn.
What is the molecular weight of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)?
The molecular weight of Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) is 368.08 g/mol.
Where can I buy Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)?
You can request a quote for Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI)?
Yes, KEHONG BIO provides custom synthesis services for Acetic acid,[(trimethylstannyl)thio]-, isooctyl ester (9CI) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.