alpha-Methyl-alpha-acetyloxybenzeneacetic acid
TL;DR: alpha-Methyl-alpha-acetyloxybenzeneacetic acid (CAS 10487-92-0) is a chemical compound with molecular formula C11H12O4 and molecular weight 208.07356 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-acetyloxy-2-phenylpropanoic acid
Also Known As: 2-acetyloxy-2-phenylpropanoic acid, d,l-O-Acetylatrolactinsaeure, 2-Acetoxy-2-phenylpropionic acid, ALPHA-METHYL-ALPHA-ACETYLOXYBENZENEACETIC ACID, 2-(ACETYLOXY)-2-PHENYLPROPANOIC ACID
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H12O4 |
| Molecular Weight | 208.07356 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.07356 Da |
| Heavy Atoms | 15 |
| Complexity | 255.0 |
| SMILES | CC(=O)OC(C)(C1=CC=CC=C1)C(=O)O |
| InChIKey | VGQZYGWEUVFRJE-UHFFFAOYSA-N |
Chemical Property Profile of alpha-Methyl-alpha-acetyloxybenzeneacetic acid
Property Insights of alpha-Methyl-alpha-acetyloxybenzeneacetic acid
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-Methyl-alpha-acetyloxybenzeneacetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-Methyl-alpha-acetyloxybenzeneacetic acid. Following Lipinski's Rule of Five, alpha-Methyl-alpha-acetyloxybenzeneacetic 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
What is the CAS number of alpha-Methyl-alpha-acetyloxybenzeneacetic acid?
The CAS number of alpha-Methyl-alpha-acetyloxybenzeneacetic acid is 10487-92-0.
What is the molecular formula of alpha-Methyl-alpha-acetyloxybenzeneacetic acid?
The molecular formula of alpha-Methyl-alpha-acetyloxybenzeneacetic acid is C11H12O4.
What is the molecular weight of alpha-Methyl-alpha-acetyloxybenzeneacetic acid?
The molecular weight of alpha-Methyl-alpha-acetyloxybenzeneacetic acid is 208.07356 g/mol.
Where can I buy alpha-Methyl-alpha-acetyloxybenzeneacetic acid?
You can request a quote for alpha-Methyl-alpha-acetyloxybenzeneacetic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for alpha-Methyl-alpha-acetyloxybenzeneacetic acid?
Yes, CoreyChem provides custom synthesis services for alpha-Methyl-alpha-acetyloxybenzeneacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.