4-Methoxybenzoic Acid
TL;DR: 4-Methoxybenzoic Acid (CAS 100-09-4) is a chemical compound with molecular formula C8H8O3 and molecular weight 152.04735 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-methoxybenzoic acid
Also Known As: p-Anisic acid, 4-METHOXYBENZOIC ACID, Draconic acid, ANISIC ACID, p-Methoxybenzoic acid
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H8O3 |
| Molecular Weight | 152.04735 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 152.04735 Da |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
| Melting Point | 185 |
| Boiling Point | 276.5 |
| Vapor Pressure | 0.0015 [mmHg] |
| Solubility | 530 |
| SMILES | COC1=CC=C(C=C1)C(=O)O |
| InChIKey | ZEYHEAKUIGZSGI-UHFFFAOYSA-N |
Product Description
Applications: 4-Methoxybenzoic 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
4-Methoxybenzoic Acid is a heterocyclic building block identified by CAS number 100-09-4 and the molecular formula C8H8O3 and a molecular weight of 152.05 g/mol. Physically, the compound has a solubility: 530. Synonyms include p-Anisic acid and 4-METHOXYBENZOIC 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 4-Methoxybenzoic Acid
Property Insights of 4-Methoxybenzoic Acid
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxybenzoic Acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Methoxybenzoic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxybenzoic 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
What is the CAS number of 4-Methoxybenzoic Acid?
The CAS number of 4-Methoxybenzoic Acid is 100-09-4.
What is the molecular formula of 4-Methoxybenzoic Acid?
The molecular formula of 4-Methoxybenzoic Acid is C8H8O3.
What is the molecular weight of 4-Methoxybenzoic Acid?
The molecular weight of 4-Methoxybenzoic Acid is 152.04735 g/mol.
What are the applications of 4-Methoxybenzoic Acid?
4-Methoxybenzoic 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. Available from CoreyChem as both catalog item and...
Where can I buy 4-Methoxybenzoic Acid?
You can request a quote for 4-Methoxybenzoic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methoxybenzoic Acid?
Yes, CoreyChem provides custom synthesis services for 4-Methoxybenzoic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.