2-(Methylthio)ethyl acrylate
TL;DR: 2-(Methylthio)ethyl acrylate (CAS 4836-09-3) is a chemical compound with molecular formula C6H10O2S and molecular weight 146.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylethyl prop-2-enoate
Also Known As: 2-(Methylthio)ethyl acrylate, 2-Methylthioethyl acrylate, methylthioethyl acrylate, Acrylic acid methylthioethyl ester, 2-(Methylthio)ethyl=acrylate
| Molecular Formula | C6H10O2S |
|---|---|
| Molecular Weight | 146.04 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 51.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 146.04015 |
| Heavy Atoms | 9 |
| Complexity | 101.0 |
Chemical Identifiers
| CAS Number | 4836-09-3 |
|---|---|
| SMILES | CSCCOC(=O)C=C |
| InChIKey | KAGWLGUCGNNPFW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methylthio)ethyl acrylate (CAS 4836-09-3), with molecular formula C6H10O2S and molecular weight 146.04 g/mol. IUPAC: 2-methylsulfanylethyl prop-2-enoate.
Chemical Property Profile of 2-(Methylthio)ethyl acrylate
Property Insights of 2-(Methylthio)ethyl acrylate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylthio)ethyl acrylate. With a topological polar surface area (TPSA) of 51.6 Ų, 2-(Methylthio)ethyl acrylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylthio)ethyl acrylate 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-(Methylthio)ethyl acrylate?
The CAS number of 2-(Methylthio)ethyl acrylate is 4836-09-3.
What is the molecular formula of 2-(Methylthio)ethyl acrylate?
The molecular formula of 2-(Methylthio)ethyl acrylate is C6H10O2S.
What is the molecular weight of 2-(Methylthio)ethyl acrylate?
The molecular weight of 2-(Methylthio)ethyl acrylate is 146.04 g/mol.
Where can I buy 2-(Methylthio)ethyl acrylate?
You can request a quote for 2-(Methylthio)ethyl acrylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylthio)ethyl acrylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylthio)ethyl acrylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.