(Methylthio)acetic acid
TL;DR: (Methylthio)acetic acid (CAS 2444-37-3) is a chemical compound with molecular formula C3H6O2S and molecular weight 106.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methylsulfanylacetic acid
Also Known As: (Methylthio)acetic acid, 2-(methylthio)acetic acid, 2-methylsulfanylacetic acid, MitomycinC, Acetic acid, (methylthio)-
| Molecular Formula | C3H6O2S |
|---|---|
| Molecular Weight | 106.01 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 106.00885 |
| Heavy Atoms | 6 |
| Complexity | 52.0 |
Chemical Identifiers
| CAS Number | 2444-37-3 |
|---|---|
| SMILES | CSCC(=O)O |
| InChIKey | HGTBAIVLETUVCG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
(Methylthio)acetic acid (CAS 2444-37-3), with molecular formula C3H6O2S and molecular weight 106.01 g/mol. IUPAC: 2-methylsulfanylacetic acid.
Chemical Property Profile of (Methylthio)acetic acid
Property Insights of (Methylthio)acetic acid
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Methylthio)acetic acid. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (Methylthio)acetic acid. Following Lipinski's Rule of Five, (Methylthio)acetic acid 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 (Methylthio)acetic acid?
The CAS number of (Methylthio)acetic acid is 2444-37-3.
What is the molecular formula of (Methylthio)acetic acid?
The molecular formula of (Methylthio)acetic acid is C3H6O2S.
What is the molecular weight of (Methylthio)acetic acid?
The molecular weight of (Methylthio)acetic acid is 106.01 g/mol.
Where can I buy (Methylthio)acetic acid?
You can request a quote for (Methylthio)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Methylthio)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (Methylthio)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.