4-Methoxyphenylacetic Acid
TL;DR: 4-Methoxyphenylacetic Acid (CAS 104-01-8) is a chemical compound with molecular formula C9H10O3 and molecular weight 166.06299 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-methoxyphenyl)acetic acid
Also Known As: 4-Methoxyphenylacetic acid, Homoanisic acid, 2-(4-methoxyphenyl)acetic acid, p-Methoxyphenylacetic acid, (4-Methoxyphenyl)acetic acid
Application Areas
Top 5 of 19 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H10O3 |
| Molecular Weight | 166.06299 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 166.06299 Da |
| Heavy Atoms | 12 |
| Complexity | 148.0 |
| Melting Point | 87 °C |
| Boiling Point | 138.00 to 140.00 °C. @ 3.00 mm Hg |
| Solubility | 18 mg/mL |
| SMILES | COC1=CC=C(C=C1)CC(=O)O |
| InChIKey | NRPFNQUDKRYCNX-UHFFFAOYSA-N |
Product Description
Applications: 4-Methoxyphenylacetic 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 4-Methoxyphenylacetic Acid (CAS 104-01-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4-Methoxyphenylacetic Acid (CAS 104-01-8) is a heterocyclic building block with the molecular formula C9H10O3 and a molecular weight of 166.06 g/mol. Key physical properties include a solubility: 18 mg/mL. It is also known as 4-Methoxyphenylacetic acid and Homoanisic 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-Methoxyphenylacetic Acid
Property Insights of 4-Methoxyphenylacetic Acid
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxyphenylacetic Acid. With a topological polar surface area (TPSA) of 46.5 Ų, 4-Methoxyphenylacetic Acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Methoxyphenylacetic 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-Methoxyphenylacetic Acid?
The CAS number of 4-Methoxyphenylacetic Acid is 104-01-8.
What is the molecular formula of 4-Methoxyphenylacetic Acid?
The molecular formula of 4-Methoxyphenylacetic Acid is C9H10O3.
What is the molecular weight of 4-Methoxyphenylacetic Acid?
The molecular weight of 4-Methoxyphenylacetic Acid is 166.06299 g/mol.
What are the applications of 4-Methoxyphenylacetic Acid?
4-Methoxyphenylacetic 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 4-Methoxyphenylacetic Acid...
Where can I buy 4-Methoxyphenylacetic Acid?
You can request a quote for 4-Methoxyphenylacetic Acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Methoxyphenylacetic Acid?
Yes, CoreyChem provides custom synthesis services for 4-Methoxyphenylacetic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.