Ethyl 2-mercaptopropionate
TL;DR: Ethyl 2-mercaptopropionate (CAS 103616-07-5) is a chemical compound with molecular formula C5H10O2S and molecular weight 134.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-sulfanylpropanoate
Also Known As: Ethyl 2-mercaptopropionate, Ethyl 2-mercaptopropanoate, Ethyl 2-sulfanylpropanoate, Ethyl thiolactate, Propanoic acid, 2-mercapto-, ethyl ester
| Molecular Formula | C5H10O2S |
|---|---|
| Molecular Weight | 134.04 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 134.04015 |
| Heavy Atoms | 8 |
| Complexity | 82.0 |
Chemical Identifiers
| CAS Number | 103616-07-5 |
|---|---|
| SMILES | CCOC(=O)C(C)S |
| InChIKey | LXXNWCFBZHKFPT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethyl 2-mercaptopropionate (CAS 103616-07-5), with molecular formula C5H10O2S and molecular weight 134.04 g/mol. IUPAC: ethyl 2-sulfanylpropanoate.
Chemical Property Profile of Ethyl 2-mercaptopropionate
Property Insights of Ethyl 2-mercaptopropionate
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-mercaptopropionate. With a topological polar surface area (TPSA) of 27.3 Ų, Ethyl 2-mercaptopropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethyl 2-mercaptopropionate has 1 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 Ethyl 2-mercaptopropionate?
The CAS number of Ethyl 2-mercaptopropionate is 103616-07-5.
What is the molecular formula of Ethyl 2-mercaptopropionate?
The molecular formula of Ethyl 2-mercaptopropionate is C5H10O2S.
What is the molecular weight of Ethyl 2-mercaptopropionate?
The molecular weight of Ethyl 2-mercaptopropionate is 134.04 g/mol.
Where can I buy Ethyl 2-mercaptopropionate?
You can request a quote for Ethyl 2-mercaptopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-mercaptopropionate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-mercaptopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.