Propionic acid, 2-methyl-2-(phenylthio)-
TL;DR: Propionic acid, 2-methyl-2-(phenylthio)- (CAS 5219-64-7) is a chemical compound with molecular formula C10H12O2S and molecular weight 196.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-2-phenylsulfanylpropanoic acid
Also Known As: 2-methyl-2-(phenylthio)propanoic acid, Sch 1600, Propionic acid, 2-methyl-2-(phenylthio)-, 2-methyl-2-phenylsulfanylpropanoic acid, Acido fenil-alpha-tioisobutirrico
| Molecular Formula | C10H12O2S |
|---|---|
| Molecular Weight | 196.06 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 62.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 196.0558 |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 5219-64-7 |
|---|---|
| SMILES | CC(C)(C(=O)O)SC1=CC=CC=C1 |
| InChIKey | UYGHXQNQIUVOES-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propionic acid, 2-methyl-2-(phenylthio)- (CAS 5219-64-7), with molecular formula C10H12O2S and molecular weight 196.06 g/mol. IUPAC: 2-methyl-2-phenylsulfanylpropanoic acid.
Chemical Property Profile of Propionic acid, 2-methyl-2-(phenylthio)-
Property Insights of Propionic acid, 2-methyl-2-(phenylthio)-
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propionic acid, 2-methyl-2-(phenylthio)-. The TPSA of 62.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Propionic acid, 2-methyl-2-(phenylthio)-. Following Lipinski's Rule of Five, Propionic acid, 2-methyl-2-(phenylthio)- 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 Propionic acid, 2-methyl-2-(phenylthio)-?
The CAS number of Propionic acid, 2-methyl-2-(phenylthio)- is 5219-64-7.
What is the molecular formula of Propionic acid, 2-methyl-2-(phenylthio)-?
The molecular formula of Propionic acid, 2-methyl-2-(phenylthio)- is C10H12O2S.
What is the molecular weight of Propionic acid, 2-methyl-2-(phenylthio)-?
The molecular weight of Propionic acid, 2-methyl-2-(phenylthio)- is 196.06 g/mol.
Where can I buy Propionic acid, 2-methyl-2-(phenylthio)-?
You can request a quote for Propionic acid, 2-methyl-2-(phenylthio)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propionic acid, 2-methyl-2-(phenylthio)-?
Yes, KEHONG BIO provides custom synthesis services for Propionic acid, 2-methyl-2-(phenylthio)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.