2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one
TL;DR: 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one (CAS 109991-30-2) is a chemical compound with molecular formula C7H8O2S2 and molecular weight 188.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfinyl-1-thiophen-2-ylethanone
Also Known As: 2-(Methylsulfinyl)-1-(2-thienyl)ethanone, Ketone, ((methylsulfinyl)methyl) 2-thienyl, omega-Methylsulfinyl alpha-acetothiophene, 2-methylsulfinyl-1-thiophen-2-ylethanone, 2-[(Methylsulfinyl)acetyl]thiophene
| Molecular Formula | C7H8O2S2 |
|---|---|
| Molecular Weight | 188.00 g/mol |
| LogP | 1.3093 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 187.99657 |
| Heavy Atoms | 11 |
| Complexity | 263.97775 |
Chemical Identifiers
| CAS Number | 109991-30-2 |
|---|---|
| SMILES | CS(=O)CC(=O)C1=CC=CS1 |
Product Overview
2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one (CAS 109991-30-2), with molecular formula C7H8O2S2 and molecular weight 188.00 g/mol. IUPAC: 2-methylsulfinyl-1-thiophen-2-ylethanone.
Chemical Property Profile of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one
Property Insights of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one
The XLogP value of 1.3093 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one. With a topological polar surface area (TPSA) of 34.14 Ų, 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one 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 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one?
The CAS number of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one is 109991-30-2.
What is the molecular formula of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one?
The molecular formula of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one is C7H8O2S2.
What is the molecular weight of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one?
The molecular weight of 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one is 188.00 g/mol.
Where can I buy 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one?
You can request a quote for 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methanesulfinyl)-1-(thiophen-2-yl)ethan-1-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.