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3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]
TL;DR: 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] (CAS 522-40-7) is a chemical compound with molecular formula C18H22O8P2 and molecular weight 428.07898 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[4-[4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate
Also Known As: fosfestrol, Diethylstilbestrol diphosphate, IWP-L6, [4-[(E)-4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate, 4,4'-(1,2-Diethylethylene)diphenyl bis(dihydrogen phosphate)
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C18H22O8P2 |
| Molecular Weight | 428.07898 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 428.07898 Da |
| Heavy Atoms | 28 |
| Complexity | 567.0 |
| SMILES | CCC(=C(CC)C1=CC=C(C=C1)OP(=O)(O)O)C2=CC=C(C=C2)OP(=O)(O)O |
| InChIKey | NLORYLAYLIXTID-UHFFFAOYSA-N |
Product Description
Applications: 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] (CAS 522-40-7) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is a pharmaceutical intermediate identified by CAS number 522-40-7 and the molecular formula C18H22O8P2 and a molecular weight of 428.08 g/mol. It is also known as fosfestrol and Diethylstilbestrol diphosphate.
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 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]
Property Insights of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]. Following Lipinski's Rule of Five, 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] has 4 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
The CAS number of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is 522-40-7.
What is the molecular formula of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
The molecular formula of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is C18H22O8P2.
What is the molecular weight of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
The molecular weight of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is 428.07898 g/mol.
What are the applications of 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] is used in pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] (CAS 522-40-7)...
Where can I buy 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
You can request a quote for 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)]?
Yes, CoreyChem provides custom synthesis services for 3-Hexene-3,4-diylbis(4,1-phenylene)bis[dihydrogen (phosphate)] and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.