p-TOLYL ISOBUTYRATE
TL;DR: p-TOLYL ISOBUTYRATE (CAS 103-93-5) is a chemical compound with molecular formula C11H14O2 and molecular weight 178.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-methylphenyl) 2-methylpropanoate
Also Known As: p-Tolyl isobutyrate, p-Cresyl isobutyrate, p-Methylphenyl isobutyrate, p-TolylIsobutyrate, p-tolylisobutyrat
Application Areas
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H14O2 |
| Molecular Weight | 178.09938 g/mol |
| XLogP | 3.2 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 178.09938 Da |
| Heavy Atoms | 13 |
| Complexity | 167.0 |
| Density | 0.990-0.997 |
| Refractive Index | 1.484-1.490 |
| Solubility | insoluble in water; soluble in oils |
| SMILES | CC1=CC=C(C=C1)OC(=O)C(C)C |
| InChIKey | UPPSFGGDKACIKP-UHFFFAOYSA-N |
Product Description
Applications: p-TOLYL ISOBUTYRATE is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies p-TOLYL ISOBUTYRATE (CAS 103-93-5) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
A surfactant raw material supplied by CoreyChem, p-TOLYL ISOBUTYRATE (CAS 103-93-5) has the molecular formula C11H14O2 and a molecular weight of 178.1 g/mol. Reported properties include a density of 0.990-0.997 g/cm³, a solubility: insoluble in water; soluble in oils. It is also known as p-Tolyl isobutyrate and p-Cresyl isobutyrate.
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 p-TOLYL ISOBUTYRATE
Property Insights of p-TOLYL ISOBUTYRATE
The XLogP value of 3.2 indicates that p-TOLYL ISOBUTYRATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, p-TOLYL ISOBUTYRATE exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, p-TOLYL ISOBUTYRATE has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of p-TOLYL ISOBUTYRATE?
The CAS number of p-TOLYL ISOBUTYRATE is 103-93-5.
What is the molecular formula of p-TOLYL ISOBUTYRATE?
The molecular formula of p-TOLYL ISOBUTYRATE is C11H14O2.
What is the molecular weight of p-TOLYL ISOBUTYRATE?
The molecular weight of p-TOLYL ISOBUTYRATE is 178.09938 g/mol.
What are the applications of p-TOLYL ISOBUTYRATE?
p-TOLYL ISOBUTYRATE is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies p-TOLYL ISOBUTYRATE (CAS 103-93-5) with custom synthesis available from...
Where can I buy p-TOLYL ISOBUTYRATE?
You can request a quote for p-TOLYL ISOBUTYRATE directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for p-TOLYL ISOBUTYRATE?
Yes, CoreyChem provides custom synthesis services for p-TOLYL ISOBUTYRATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.