4-Propylanisole
TL;DR: 4-Propylanisole (CAS 104-45-0) is a chemical compound with molecular formula C10H14O and molecular weight 150.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methoxy-4-propylbenzene
Also Known As: 4-Propylanisole, 1-Methoxy-4-propylbenzene, Dihydroanethole, p-Propylanisole, p-Propyl anisole
Application Areas
Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H14O |
| Molecular Weight | 150.10446 g/mol |
| XLogP | 3.5 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 150.10446 Da |
| Heavy Atoms | 11 |
| Complexity | 93.0 |
| Boiling Point | 212.00 to 213.00 °C. @ 760.00 mm Hg |
| Density | 0.940-0.943 |
| Refractive Index | 1.503-1.506 |
| Solubility | Slightly soluble in water, Miscible in oils |
| SMILES | CCCC1=CC=C(C=C1)OC |
| InChIKey | KBHWKXNXTURZCD-UHFFFAOYSA-N |
Product Description
Applications: 4-Propylanisole is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Propylanisole (CAS 104-45-0) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
4-Propylanisole (CAS 104-45-0) is a pharmaceutical intermediate with the molecular formula C10H14O and a molecular weight of 150.1 g/mol. Key physical properties include a density of 0.940-0.943 g/cm³, a solubility: Slightly soluble in water, Miscible in oils. It is also known as 4-Propylanisole and 1-Methoxy-4-propylbenzene.
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-Propylanisole
Property Insights of 4-Propylanisole
The XLogP value of 3.5 indicates that 4-Propylanisole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, 4-Propylanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Propylanisole has 0 hydrogen bond donor(s) and 1 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-Propylanisole?
The CAS number of 4-Propylanisole is 104-45-0.
What is the molecular formula of 4-Propylanisole?
The molecular formula of 4-Propylanisole is C10H14O.
What is the molecular weight of 4-Propylanisole?
The molecular weight of 4-Propylanisole is 150.10446 g/mol.
What are the applications of 4-Propylanisole?
4-Propylanisole is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 4-Propylanisole (CAS 104-45-0) with...
Where can I buy 4-Propylanisole?
You can request a quote for 4-Propylanisole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-Propylanisole?
Yes, CoreyChem provides custom synthesis services for 4-Propylanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.