Methyl 2-mercaptopropionate
TL;DR: Methyl 2-mercaptopropionate (CAS 53907-46-3) is a chemical compound with molecular formula C4H8O2S and molecular weight 120.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-sulfanylpropanoate
Also Known As: Methyl 2-mercaptopropionate, Methyl 2-sulfanylpropanoate, methyl 2-mercaptopropanoate, Methyl mercaptopropionate, 2-Mercaptopropionic acid methyl ester
| Molecular Formula | C4H8O2S |
|---|---|
| Molecular Weight | 120.02 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 27.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 120.0245 |
| Heavy Atoms | 7 |
| Complexity | 72.0 |
Chemical Identifiers
| CAS Number | 53907-46-3 |
|---|---|
| SMILES | CC(C(=O)OC)S |
| InChIKey | SNWKNPMDQONHKK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl 2-mercaptopropionate (CAS 53907-46-3), with molecular formula C4H8O2S and molecular weight 120.02 g/mol. IUPAC: methyl 2-sulfanylpropanoate.
Chemical Property Profile of Methyl 2-mercaptopropionate
Property Insights of Methyl 2-mercaptopropionate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 2-mercaptopropionate. With a topological polar surface area (TPSA) of 27.3 Ų, Methyl 2-mercaptopropionate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 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 Methyl 2-mercaptopropionate?
The CAS number of Methyl 2-mercaptopropionate is 53907-46-3.
What is the molecular formula of Methyl 2-mercaptopropionate?
The molecular formula of Methyl 2-mercaptopropionate is C4H8O2S.
What is the molecular weight of Methyl 2-mercaptopropionate?
The molecular weight of Methyl 2-mercaptopropionate is 120.02 g/mol.
Where can I buy Methyl 2-mercaptopropionate?
You can request a quote for Methyl 2-mercaptopropionate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-mercaptopropionate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-mercaptopropionate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.