2,4-Dibromo-17-estradiol
TL;DR: 2,4-Dibromo-17-estradiol (CAS 19590-55-7) is a chemical compound with molecular formula C18H22Br2O2 and molecular weight 427.99866 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8R,9S,13S,14S,17S)-2,4-dibromo-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Also Known As: 2,4-Dibromoestradiol, 2,4-Dibromo-17-estradiol, Estradiol impurity 48, Estradiol Impurity 43, 2,4-Dibromo-17beta-estradiol
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22Br2O2 |
| Molecular Weight | 427.99866 g/mol |
| XLogP | 5.4 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 429.9966 Da |
| Heavy Atoms | 22 |
| Complexity | 445.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C(C(=C(C=C34)Br)O)Br |
| InChIKey | UTXNYGUZJLLOSP-ZICKVNAASA-N |
Chemical Property Profile of 2,4-Dibromo-17-estradiol
Property Insights of 2,4-Dibromo-17-estradiol
The XLogP value of 5.4 indicates that 2,4-Dibromo-17-estradiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 2,4-Dibromo-17-estradiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dibromo-17-estradiol has 2 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 2,4-Dibromo-17-estradiol?
The CAS number of 2,4-Dibromo-17-estradiol is 19590-55-7.
What is the molecular formula of 2,4-Dibromo-17-estradiol?
The molecular formula of 2,4-Dibromo-17-estradiol is C18H22Br2O2.
What is the molecular weight of 2,4-Dibromo-17-estradiol?
The molecular weight of 2,4-Dibromo-17-estradiol is 427.99866 g/mol.
Where can I buy 2,4-Dibromo-17-estradiol?
You can request a quote for 2,4-Dibromo-17-estradiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dibromo-17-estradiol?
Yes, CoreyChem provides custom synthesis services for 2,4-Dibromo-17-estradiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.