2-Hydroxyisobutyric acid
TL;DR: 2-Hydroxyisobutyric acid (CAS 594-61-6) is a chemical compound with molecular formula C4H8O3 and molecular weight 104.04734 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-hydroxy-2-methylpropanoic acid
Also Known As: 2-HYDROXYISOBUTYRIC ACID, 2-Methyllactic acid, Acetonic acid, 2-Hydroxy-2-methylpropanoic acid, alpha-Hydroxyisobutyric acid
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C4H8O3 |
| Molecular Weight | 104.04734 g/mol |
| XLogP | -0.4 |
| Topological Polar Surface Area (TPSA) | 57.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 104.04734 Da |
| Heavy Atoms | 7 |
| Complexity | 84.0 |
| Melting Point | 82.5 °C |
| Boiling Point | 212.00 °C. @ 760.00 mm Hg |
| SMILES | CC(C)(C(=O)O)O |
| InChIKey | BWLBGMIXKSTLSX-UHFFFAOYSA-N |
Chemical Property Profile of 2-Hydroxyisobutyric acid
Property Insights of 2-Hydroxyisobutyric acid
The XLogP value of -0.4 indicates that 2-Hydroxyisobutyric acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 57.5 Ų, 2-Hydroxyisobutyric acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hydroxyisobutyric acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Hydroxyisobutyric acid?
The CAS number of 2-Hydroxyisobutyric acid is 594-61-6.
What is the molecular formula of 2-Hydroxyisobutyric acid?
The molecular formula of 2-Hydroxyisobutyric acid is C4H8O3.
What is the molecular weight of 2-Hydroxyisobutyric acid?
The molecular weight of 2-Hydroxyisobutyric acid is 104.04734 g/mol.
Where can I buy 2-Hydroxyisobutyric acid?
You can request a quote for 2-Hydroxyisobutyric acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Hydroxyisobutyric acid?
Yes, CoreyChem provides custom synthesis services for 2-Hydroxyisobutyric acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.