(11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione
TL;DR: (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione (CAS 6678-14-4) is a chemical compound with molecular formula C29H44O6 and molecular weight 488.31378 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[2-[(8S,9S,10R,11S,13S,14S,17R)-11,17-dihydroxy-10,13-dimethyl-3-oxo-2,6,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] octanoate
Also Known As: Cortisol octanoate, Hydrocortisone 21-octanoate, hydrocortisone caprylate, hydrocortisone octanoate, Hydrocortisone 21-caprylate
Application Areas
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C29H44O6 |
| Molecular Weight | 488.31378 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 488.31378 Da |
| Heavy Atoms | 35 |
| Complexity | 878.0 |
| SMILES | CCCCCCCC(=O)OCC(=O)[C@]1(CC[C@@H]2[C@@]1(C[C@@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C)O |
| InChIKey | VWVPRYMOFYIOOZ-KAQKJVHQSA-N |
Chemical Property Profile of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione
Property Insights of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione
The XLogP value of 5.2 indicates that (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione. Following Lipinski's Rule of Five, (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione?
The CAS number of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione is 6678-14-4.
What is the molecular formula of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione?
The molecular formula of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione is C29H44O6.
What is the molecular weight of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione?
The molecular weight of (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione is 488.31378 g/mol.
Where can I buy (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione?
You can request a quote for (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione?
Yes, CoreyChem provides custom synthesis services for (11beta)-11,17-Dihydroxy-21-((1-oxooctyl)oxy)pregn-4-ene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.