9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
TL;DR: 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione (CAS 4419-39-0) is a chemical compound with molecular formula C22H29ClO5 and molecular weight 408.17035 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
9-chloro-11,17-dihydroxy-17-(2-hydroxyacetyl)-10,13,16-trimethyl-6,7,8,11,12,14,15,16-octahydrocyclopenta[a]phenanthren-3-one
Also Known As: beclomethasone, Beclometasone, 9.alpha.-Chloro-16.beta.-methylprednisolone, BRD-A73385064-001-01-5, 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
Technical Specifications
| Molecular Formula | C22H29ClO5 |
| Molecular Weight | 408.17035 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 408.17035 Da |
| Heavy Atoms | 28 |
| Complexity | 805.0 |
| SMILES | CC1CC2C3CCC4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)CO)O)C)O)Cl)C |
| InChIKey | NBMKJKDGKREAPL-UHFFFAOYSA-N |
Product Description
Applications: 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione is used in organic synthesis and process chemistry. 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).
9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione (CAS 4419-39-0) is a fine chemical with the molecular formula C22H29ClO5 and a molecular weight of 408.17 g/mol. Synonyms include beclomethasone and Beclometasone.
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 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
Property Insights of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione. Following Lipinski's Rule of Five, 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
The CAS number of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione is 4419-39-0.
What is the molecular formula of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
The molecular formula of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione is C22H29ClO5.
What is the molecular weight of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
The molecular weight of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione is 408.17035 g/mol.
What are the applications of 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione is used in organic synthesis and process chemistry. 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...
Where can I buy 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
You can request a quote for 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione?
Yes, CoreyChem provides custom synthesis services for 9-Chloro-11,17,21-trihydroxy-16-methylpregna-1,4-diene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.