21,21-Dichloroprogesterone
TL;DR: 21,21-Dichloroprogesterone (CAS 117038-59-2) is a chemical compound with molecular formula C21H28Cl2O2 and molecular weight 382.14664 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8S,9S,10R,13S,14S,17S)-17-(2,2-dichloroacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Also Known As: 21,21-Dichloroprogesterone, 21,21-Dcp, 21,21-Dichloropregn-4-ene-3,20-dione, Pregn-4-ene-3,20-dione, 21,21-dichloro-, (8S,9S,10R,13S,14S,17S)-17-(2,2-dichloroacetyl)-10,13-dimethyl-1,2,6,7,8,9,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthren-3-one
Technical Specifications
| Molecular Formula | C21H28Cl2O2 |
| Molecular Weight | 382.14664 g/mol |
| XLogP | 5.2 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 382.14664 Da |
| Heavy Atoms | 25 |
| Complexity | 640.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)C(Cl)Cl)CCC4=CC(=O)CC[C@]34C |
| InChIKey | FDEHPBNJFZBCBX-GQDVPIKJSA-N |
Chemical Property Profile of 21,21-Dichloroprogesterone
Property Insights of 21,21-Dichloroprogesterone
The XLogP value of 5.2 indicates that 21,21-Dichloroprogesterone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 34.1 Ų, 21,21-Dichloroprogesterone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 21,21-Dichloroprogesterone has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 21,21-Dichloroprogesterone?
The CAS number of 21,21-Dichloroprogesterone is 117038-59-2.
What is the molecular formula of 21,21-Dichloroprogesterone?
The molecular formula of 21,21-Dichloroprogesterone is C21H28Cl2O2.
What is the molecular weight of 21,21-Dichloroprogesterone?
The molecular weight of 21,21-Dichloroprogesterone is 382.14664 g/mol.
Where can I buy 21,21-Dichloroprogesterone?
You can request a quote for 21,21-Dichloroprogesterone directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 21,21-Dichloroprogesterone?
Yes, CoreyChem provides custom synthesis services for 21,21-Dichloroprogesterone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.