3,4,5-Trimethoxybenzoic Acid
TL;DR: 3,4,5-Trimethoxybenzoic Acid (CAS 118-41-2) is a chemical compound with molecular formula C10H12O5 and molecular weight 212.06847 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-trimethoxybenzoic acid
Also Known As: 3,4,5-TRIMETHOXYBENZOIC ACID, Eudesmic acid, Trimethylgallic acid, Gallic acid trimethyl ether, Tri-O-methylgallic acid
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H12O5 |
| Molecular Weight | 212.06847 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 65.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 212.06847 Da |
| Heavy Atoms | 15 |
| Complexity | 204.0 |
| Melting Point | 171 - 172 °C |
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)O |
| InChIKey | SJSOFNCYXJUNBT-UHFFFAOYSA-N |
Product Description
Applications: 3,4,5-Trimethoxybenzoic Acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3,4,5-Trimethoxybenzoic Acid (CAS 118-41-2) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
3,4,5-Trimethoxybenzoic Acid is a heterocyclic building block identified by CAS number 118-41-2 and the molecular formula C10H12O5 and a molecular weight of 212.07 g/mol. It is also known as 3,4,5-TRIMETHOXYBENZOIC ACID and Eudesmic acid.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 3,4,5-Trimethoxybenzoic Acid
Property Insights of 3,4,5-Trimethoxybenzoic Acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-Trimethoxybenzoic Acid. The TPSA of 65.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5-Trimethoxybenzoic Acid. Following Lipinski's Rule of Five, 3,4,5-Trimethoxybenzoic 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
What is the CAS number of 3,4,5-Trimethoxybenzoic Acid?
The CAS number of 3,4,5-Trimethoxybenzoic Acid is 118-41-2.
What is the molecular formula of 3,4,5-Trimethoxybenzoic Acid?
The molecular formula of 3,4,5-Trimethoxybenzoic Acid is C10H12O5.
What is the molecular weight of 3,4,5-Trimethoxybenzoic Acid?
The molecular weight of 3,4,5-Trimethoxybenzoic Acid is 212.06847 g/mol.
What are the applications of 3,4,5-Trimethoxybenzoic Acid?
3,4,5-Trimethoxybenzoic Acid is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3,4,5-Trimethoxybenzoic...
Where can I buy 3,4,5-Trimethoxybenzoic Acid?
You can request a quote for 3,4,5-Trimethoxybenzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3,4,5-Trimethoxybenzoic Acid?
Yes, CoreyChem provides custom synthesis services for 3,4,5-Trimethoxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.