(5-Acetyl-2-methoxyphenyl)acetic acid
TL;DR: (5-Acetyl-2-methoxyphenyl)acetic acid (CAS 116296-30-1) is a chemical compound with molecular formula C11H12O4 and molecular weight 208.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(5-acetyl-2-methoxyphenyl)acetic acid
Also Known As: (5-acetyl-2-methoxyphenyl)acetic acid, 2-(5-acetyl-2-methoxyphenyl)acetic acid, Benzeneacetic acid, 5-acetyl-2-methoxy-, Benzeneacetic acid,5-acetyl-2-methoxy-, 5-acetyl-2-methoxyBenzeneacetic acid
| Molecular Formula | C11H12O4 |
|---|---|
| Molecular Weight | 208.07 g/mol |
| LogP | 1.5249 |
| Topological Polar Surface Area | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.07356 |
| Heavy Atoms | 15 |
| Complexity | 395.57443 |
Chemical Identifiers
| CAS Number | 116296-30-1 |
|---|---|
| SMILES | CC(=O)C1=CC(=C(C=C1)OC)CC(=O)O |
Product Overview
(5-Acetyl-2-methoxyphenyl)acetic acid (CAS 116296-30-1), with molecular formula C11H12O4 and molecular weight 208.07 g/mol. IUPAC: 2-(5-acetyl-2-methoxyphenyl)acetic acid.
Chemical Property Profile of (5-Acetyl-2-methoxyphenyl)acetic acid
Property Insights of (5-Acetyl-2-methoxyphenyl)acetic acid
The XLogP value of 1.5249 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (5-Acetyl-2-methoxyphenyl)acetic acid. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (5-Acetyl-2-methoxyphenyl)acetic acid. Following Lipinski's Rule of Five, (5-Acetyl-2-methoxyphenyl)acetic acid 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 (5-Acetyl-2-methoxyphenyl)acetic acid?
The CAS number of (5-Acetyl-2-methoxyphenyl)acetic acid is 116296-30-1.
What is the molecular formula of (5-Acetyl-2-methoxyphenyl)acetic acid?
The molecular formula of (5-Acetyl-2-methoxyphenyl)acetic acid is C11H12O4.
What is the molecular weight of (5-Acetyl-2-methoxyphenyl)acetic acid?
The molecular weight of (5-Acetyl-2-methoxyphenyl)acetic acid is 208.07 g/mol.
Where can I buy (5-Acetyl-2-methoxyphenyl)acetic acid?
You can request a quote for (5-Acetyl-2-methoxyphenyl)acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (5-Acetyl-2-methoxyphenyl)acetic acid?
Yes, KEHONG BIO provides custom synthesis services for (5-Acetyl-2-methoxyphenyl)acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.