![{[(Thiophen-2-yl)methyl]sulfanyl}acetate structure](/static/products/4984/49846-99-3.webp)
{[(Thiophen-2-yl)methyl]sulfanyl}acetate
TL;DR: {[(Thiophen-2-yl)methyl]sulfanyl}acetate (CAS 49846-99-3) is a chemical compound with molecular formula C7H7O2S2- and molecular weight 186.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(thiophen-2-ylmethylsulfanyl)acetate
Also Known As: 2-(thiophen-2-ylmethylsulfanyl)acetate, {[(Thiophen-2-yl)methyl]sulfanyl}acetate
| Molecular Formula | C7H7O2S2- |
|---|---|
| Molecular Weight | 186.99 g/mol |
| LogP | 0.7312 |
| Topological Polar Surface Area | 40.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 186.98875 |
| Heavy Atoms | 11 |
| Complexity | 218.35426 |
Chemical Identifiers
| CAS Number | 49846-99-3 |
|---|---|
| SMILES | C1=CSC(=C1)CSCC(=O)[O-] |
Product Overview
{[(Thiophen-2-yl)methyl]sulfanyl}acetate (CAS 49846-99-3), with molecular formula C7H7O2S2- and molecular weight 186.99 g/mol. IUPAC: 2-(thiophen-2-ylmethylsulfanyl)acetate.
Chemical Property Profile of {[(Thiophen-2-yl)methyl]sulfanyl}acetate
Property Insights of {[(Thiophen-2-yl)methyl]sulfanyl}acetate
The XLogP value of 0.7312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for {[(Thiophen-2-yl)methyl]sulfanyl}acetate. With a topological polar surface area (TPSA) of 40.13 Ų, {[(Thiophen-2-yl)methyl]sulfanyl}acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, {[(Thiophen-2-yl)methyl]sulfanyl}acetate has 0 hydrogen bond donor(s) and 4 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 {[(Thiophen-2-yl)methyl]sulfanyl}acetate?
The CAS number of {[(Thiophen-2-yl)methyl]sulfanyl}acetate is 49846-99-3.
What is the molecular formula of {[(Thiophen-2-yl)methyl]sulfanyl}acetate?
The molecular formula of {[(Thiophen-2-yl)methyl]sulfanyl}acetate is C7H7O2S2-.
What is the molecular weight of {[(Thiophen-2-yl)methyl]sulfanyl}acetate?
The molecular weight of {[(Thiophen-2-yl)methyl]sulfanyl}acetate is 186.99 g/mol.
Where can I buy {[(Thiophen-2-yl)methyl]sulfanyl}acetate?
You can request a quote for {[(Thiophen-2-yl)methyl]sulfanyl}acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {[(Thiophen-2-yl)methyl]sulfanyl}acetate?
Yes, KEHONG BIO provides custom synthesis services for {[(Thiophen-2-yl)methyl]sulfanyl}acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.