Methyl alpha-hydroxyisobutyrate
TL;DR: Methyl alpha-hydroxyisobutyrate (CAS 2110-78-3) is a chemical compound with molecular formula C5H10O3 and molecular weight 118.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-2-methylpropanoate
Also Known As: Methyl 2-hydroxyisobutyrate, Methyl 2-hydroxy-2-methylpropanoate, Methyl 2-methyllactate, Methyl2-hydroxyisobutyrate, methyl
| Molecular Formula | C5H10O3 |
|---|---|
| Molecular Weight | 118.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 118.062996 |
| Heavy Atoms | 8 |
| Complexity | 95.0 |
Chemical Identifiers
| CAS Number | 2110-78-3 |
|---|---|
| SMILES | CC(C)(C(=O)OC)O |
| InChIKey | XYVQFUJDGOBPQI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 18 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl alpha-hydroxyisobutyrate (CAS 2110-78-3), with molecular formula C5H10O3 and molecular weight 118.06 g/mol. IUPAC: methyl 2-hydroxy-2-methylpropanoate.
Chemical Property Profile of Methyl alpha-hydroxyisobutyrate
Property Insights of Methyl alpha-hydroxyisobutyrate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl alpha-hydroxyisobutyrate. With a topological polar surface area (TPSA) of 46.5 Ų, Methyl alpha-hydroxyisobutyrate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl alpha-hydroxyisobutyrate 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 alpha-hydroxyisobutyrate?
The CAS number of Methyl alpha-hydroxyisobutyrate is 2110-78-3.
What is the molecular formula of Methyl alpha-hydroxyisobutyrate?
The molecular formula of Methyl alpha-hydroxyisobutyrate is C5H10O3.
What is the molecular weight of Methyl alpha-hydroxyisobutyrate?
The molecular weight of Methyl alpha-hydroxyisobutyrate is 118.06 g/mol.
Where can I buy Methyl alpha-hydroxyisobutyrate?
You can request a quote for Methyl alpha-hydroxyisobutyrate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl alpha-hydroxyisobutyrate?
Yes, KEHONG BIO provides custom synthesis services for Methyl alpha-hydroxyisobutyrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.