9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione
TL;DR: 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione (CAS 4469-34-5) is a chemical compound with molecular formula C22H31FO3 and molecular weight 362.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6S,8S,9R,10S,11S,13S,14S,17S)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
Also Known As: EINECS 206-824-9, FDA 0094, 9-Fluoro-11beta-hydroxy-6alpha-methylpregn-4-ene-3,20-dione, 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione, (6S,8S,9R,10S,11S,13S,14S,17S)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one
| Molecular Formula | C22H31FO3 |
|---|---|
| Molecular Weight | 362.23 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 362.2257 |
| Heavy Atoms | 26 |
| Complexity | 700.0 |
Chemical Identifiers
| CAS Number | 4469-34-5 |
|---|---|
| SMILES | C[C@H]1C[C@H]2[C@@H]3CC[C@@H]([C@]3(C[C@@H]([C@@]2([C@@]4(C1=CC(=O)CC4)C)F)O)C)C(=O)C |
| InChIKey | RWGSFMGQJFCHTC-ORKYMPNQSA-N |
Product Overview
9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione (CAS 4469-34-5), with molecular formula C22H31FO3 and molecular weight 362.23 g/mol. IUPAC: (6S,8S,9R,10S,11S,13S,14S,17S)-17-acetyl-9-fluoro-11-hydroxy-6,10,13-trimethyl-2,6,7,8,11,12,14,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-one.
Chemical Property Profile of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione
Property Insights of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione. With a topological polar surface area (TPSA) of 54.4 Ų, 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione?
The CAS number of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione is 4469-34-5.
What is the molecular formula of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione?
The molecular formula of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione is C22H31FO3.
What is the molecular weight of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione?
The molecular weight of 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione is 362.23 g/mol.
Where can I buy 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione?
You can request a quote for 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione?
Yes, KEHONG BIO provides custom synthesis services for 9alpha-Fluoro-11beta-hydroxy-6alpha-methyl-4-pregnene-3,20-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.