Cyclandelate
TL;DR: Cyclandelate (CAS 456-59-7) is a chemical compound with molecular formula C17H24O3 and molecular weight 276.17255 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,3,5-trimethylcyclohexyl) 2-hydroxy-2-phenylacetate
Also Known As: cyclandelate, Cyclomandol, Cyclolyt, Cyclospasmol, Perebral
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C17H24O3 |
| Molecular Weight | 276.17255 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 276.17255 Da |
| Heavy Atoms | 20 |
| Complexity | 331.0 |
| Melting Point | 50-53 |
| Boiling Point | 193 |
| Solubility | PRACTICALLY INSOL IN WATER; SOL IN LIPOIDS & THEIR SOLVENTS |
| SMILES | CC1CC(CC(C1)(C)C)OC(=O)C(C2=CC=CC=C2)O |
| InChIKey | WZHCOOQXZCIUNC-UHFFFAOYSA-N |
Product Description
Applications: Cyclandelate 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).
A pharmaceutical intermediate supplied by CoreyChem, Cyclandelate (CAS 456-59-7) has the molecular formula C17H24O3 and a molecular weight of 276.17 g/mol. Reported properties include a solubility: PRACTICALLY INSOL IN WATER; SOL IN LIPOIDS & THEIR SOLVENTS. Synonyms include cyclandelate and Cyclomandol.
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 Cyclandelate
Property Insights of Cyclandelate
The XLogP value of 4.2 indicates that Cyclandelate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, Cyclandelate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclandelate 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 Cyclandelate?
The CAS number of Cyclandelate is 456-59-7.
What is the molecular formula of Cyclandelate?
The molecular formula of Cyclandelate is C17H24O3.
What is the molecular weight of Cyclandelate?
The molecular weight of Cyclandelate is 276.17255 g/mol.
What are the applications of Cyclandelate?
Cyclandelate 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 Cyclandelate?
You can request a quote for Cyclandelate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Cyclandelate?
Yes, CoreyChem provides custom synthesis services for Cyclandelate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.