halopredone acetate
TL;DR: halopredone acetate (CAS 57781-14-3) is a chemical compound with molecular formula C25H29BrF2O7 and molecular weight 558.10645 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-(17-acetyloxy-2-bromo-6,9-difluoro-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Also Known As: halopredone acetate, 2-Bromo-6beta,9-difluoro-11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate), [2-(17-acetyloxy-2-bromo-6,9-difluoro-11-hydroxy-10,13-dimethyl-3-oxo-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-17-yl)-2-oxoethyl] acetate
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C25H29BrF2O7 |
| Molecular Weight | 558.10645 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 107.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 558.10645 Da |
| Heavy Atoms | 35 |
| Complexity | 1070.0 |
| SMILES | CC(=O)OCC(=O)C1(CCC2C1(CC(C3(C2CC(C4=CC(=O)C(=CC43C)Br)F)F)O)C)OC(=O)C |
| InChIKey | YCISZOVUHXIOFY-UHFFFAOYSA-N |
Product Description
Applications: halopredone acetate is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies halopredone acetate (CAS 57781-14-3) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
halopredone acetate is a pharmaceutical intermediate identified by CAS number 57781-14-3 and the molecular formula C25H29BrF2O7 and a molecular weight of 558.11 g/mol. It is also known as halopredone acetate and 2-Bromo-6beta,9-difluoro-11beta,17,21-trihydroxypregna-1,4-diene-3,20-dione 17,21-di(acetate).
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 halopredone acetate
Property Insights of halopredone acetate
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for halopredone acetate. The TPSA of 107.0 Ų falls within the moderate polarity range, balancing permeability and solubility for halopredone acetate. Following Lipinski's Rule of Five, halopredone acetate has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of halopredone acetate?
The CAS number of halopredone acetate is 57781-14-3.
What is the molecular formula of halopredone acetate?
The molecular formula of halopredone acetate is C25H29BrF2O7.
What is the molecular weight of halopredone acetate?
The molecular weight of halopredone acetate is 558.10645 g/mol.
What are the applications of halopredone acetate?
halopredone acetate is used in pharmaceutical synthesis routes and API production, as well as biotechnology workflows and life-science research. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies halopredone acetate (CAS 57781-14-3) with custom synthesis...
Where can I buy halopredone acetate?
You can request a quote for halopredone acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for halopredone acetate?
Yes, CoreyChem provides custom synthesis services for halopredone acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.