Isopropyl Stearate
TL;DR: Isopropyl Stearate (CAS 112-10-7) is a chemical compound with molecular formula C21H42O2 and molecular weight 326.31848 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl octadecanoate
Also Known As: ISOPROPYL STEARATE, Wickenol 127, propan-2-yl octadecanoate, Benproperine, Revenge
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C21H42O2 |
| Molecular Weight | 326.31848 g/mol |
| XLogP | 9.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 18 |
| Exact Mass | 326.31848 Da |
| Heavy Atoms | 23 |
| Complexity | 248.0 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)OC(C)C |
| InChIKey | ZPWFUIUNWDIYCJ-UHFFFAOYSA-N |
Product Description
Applications: Isopropyl Stearate 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Isopropyl Stearate (CAS 112-10-7) is a pharmaceutical intermediate with the molecular formula C21H42O2 and a molecular weight of 326.32 g/mol. Synonyms include ISOPROPYL STEARATE and Wickenol 127.
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 Isopropyl Stearate
Property Insights of Isopropyl Stearate
The XLogP value of 9.3 indicates that Isopropyl Stearate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Isopropyl Stearate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl Stearate has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Isopropyl Stearate?
The CAS number of Isopropyl Stearate is 112-10-7.
What is the molecular formula of Isopropyl Stearate?
The molecular formula of Isopropyl Stearate is C21H42O2.
What is the molecular weight of Isopropyl Stearate?
The molecular weight of Isopropyl Stearate is 326.31848 g/mol.
What are the applications of Isopropyl Stearate?
Isopropyl Stearate 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. Available from CoreyChem as both catalog item and...
Where can I buy Isopropyl Stearate?
You can request a quote for Isopropyl Stearate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isopropyl Stearate?
Yes, CoreyChem provides custom synthesis services for Isopropyl Stearate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.