2-(4-Acetylphenoxy)-2-methylpropionic acid
TL;DR: 2-(4-Acetylphenoxy)-2-methylpropionic acid (CAS 52179-07-4) is a chemical compound with molecular formula C12H14O4 and molecular weight 222.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-acetylphenoxy)-2-methylpropanoic acid
Also Known As: 2-(4-Acetylphenoxy)-2-methylpropanoic acid, 2-(4-Acetylphenoxy)-2-methylpropionic acid, Propanoic acid, 2-(4-acetylphenoxy)-2-methyl-, 2-(4-acetyl-phenoxy)-2-methyl-propionic acid, 2-(p-acetylphenoxy)-2-methylpropionic acid
| Molecular Formula | C12H14O4 |
|---|---|
| Molecular Weight | 222.09 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.0892 |
| Heavy Atoms | 16 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 52179-07-4 |
|---|---|
| SMILES | CC(=O)C1=CC=C(C=C1)OC(C)(C)C(=O)O |
| InChIKey | CDUYSGJRDZEJPK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(4-Acetylphenoxy)-2-methylpropionic acid (CAS 52179-07-4), with molecular formula C12H14O4 and molecular weight 222.09 g/mol. IUPAC: 2-(4-acetylphenoxy)-2-methylpropanoic acid.
Chemical Property Profile of 2-(4-Acetylphenoxy)-2-methylpropionic acid
Property Insights of 2-(4-Acetylphenoxy)-2-methylpropionic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Acetylphenoxy)-2-methylpropionic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Acetylphenoxy)-2-methylpropionic acid. Following Lipinski's Rule of Five, 2-(4-Acetylphenoxy)-2-methylpropionic acid has 1 hydrogen bond donor(s) and 4 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 2-(4-Acetylphenoxy)-2-methylpropionic acid?
The CAS number of 2-(4-Acetylphenoxy)-2-methylpropionic acid is 52179-07-4.
What is the molecular formula of 2-(4-Acetylphenoxy)-2-methylpropionic acid?
The molecular formula of 2-(4-Acetylphenoxy)-2-methylpropionic acid is C12H14O4.
What is the molecular weight of 2-(4-Acetylphenoxy)-2-methylpropionic acid?
The molecular weight of 2-(4-Acetylphenoxy)-2-methylpropionic acid is 222.09 g/mol.
Where can I buy 2-(4-Acetylphenoxy)-2-methylpropionic acid?
You can request a quote for 2-(4-Acetylphenoxy)-2-methylpropionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Acetylphenoxy)-2-methylpropionic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Acetylphenoxy)-2-methylpropionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.