1-Fluoroestradiol
TL;DR: 1-Fluoroestradiol (CAS 103419-09-6) is a chemical compound with molecular formula C18H23FO2 and molecular weight 290.1682 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(8S,9S,13S,14S,17S)-1-fluoro-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Also Known As: 1-Fluoroestradiol, 1-Fluoroestra-1(10),2,4-triene-3,17-diol, 1-Fluoroestra-1(10),2,4-triene-3,17beta-diol, 1-fluoroestra-1,3,5(10)-trien-3,17beta-diol, (8S,9S,13S,14S,17S)-1-fluoro-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthrene-3,17-diol
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H23FO2 |
| Molecular Weight | 290.1682 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 290.1682 Da |
| Heavy Atoms | 21 |
| Complexity | 414.0 |
| SMILES | C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2O)CCC4=C3C(=CC(=C4)O)F |
| InChIKey | VAYVDUJKHGYLSR-PEEYHIECSA-N |
Chemical Property Profile of 1-Fluoroestradiol
Property Insights of 1-Fluoroestradiol
The XLogP value of 4.1 indicates that 1-Fluoroestradiol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1-Fluoroestradiol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoroestradiol has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Fluoroestradiol?
The CAS number of 1-Fluoroestradiol is 103419-09-6.
What is the molecular formula of 1-Fluoroestradiol?
The molecular formula of 1-Fluoroestradiol is C18H23FO2.
What is the molecular weight of 1-Fluoroestradiol?
The molecular weight of 1-Fluoroestradiol is 290.1682 g/mol.
Where can I buy 1-Fluoroestradiol?
You can request a quote for 1-Fluoroestradiol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Fluoroestradiol?
Yes, CoreyChem provides custom synthesis services for 1-Fluoroestradiol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.