2,3,4-Trimethoxyphenylacetic acid
TL;DR: 2,3,4-Trimethoxyphenylacetic acid (CAS 22480-91-7) is a chemical compound with molecular formula C11H14O5 and molecular weight 226.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2,3,4-trimethoxyphenyl)acetic acid
Also Known As: 2,3,4-Trimethoxyphenylacetic acid, 2-(2,3,4-trimethoxyphenyl)acetic acid, (2,3,4-Trimethoxyphenyl)acetic acid, Benzeneacetic acid, 2,3,4-trimethoxy-, RARECHEM AL BO 0583
| Molecular Formula | C11H14O5 |
|---|---|
| Molecular Weight | 226.08 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 226.08412 |
| Heavy Atoms | 16 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 22480-91-7 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)CC(=O)O)OC)OC |
| InChIKey | ZMWCKCLDAQWIDA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3,4-Trimethoxyphenylacetic acid (CAS 22480-91-7), with molecular formula C11H14O5 and molecular weight 226.08 g/mol. IUPAC: 2-(2,3,4-trimethoxyphenyl)acetic acid.
Chemical Property Profile of 2,3,4-Trimethoxyphenylacetic acid
Property Insights of 2,3,4-Trimethoxyphenylacetic acid
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trimethoxyphenylacetic acid. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4-Trimethoxyphenylacetic acid. Following Lipinski's Rule of Five, 2,3,4-Trimethoxyphenylacetic acid has 1 hydrogen bond donor(s) and 5 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 2,3,4-Trimethoxyphenylacetic acid?
The CAS number of 2,3,4-Trimethoxyphenylacetic acid is 22480-91-7.
What is the molecular formula of 2,3,4-Trimethoxyphenylacetic acid?
The molecular formula of 2,3,4-Trimethoxyphenylacetic acid is C11H14O5.
What is the molecular weight of 2,3,4-Trimethoxyphenylacetic acid?
The molecular weight of 2,3,4-Trimethoxyphenylacetic acid is 226.08 g/mol.
Where can I buy 2,3,4-Trimethoxyphenylacetic acid?
You can request a quote for 2,3,4-Trimethoxyphenylacetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4-Trimethoxyphenylacetic acid?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4-Trimethoxyphenylacetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.