磷雌酚
TL;DR: 磷雌酚 (CAS 522-40-7) is a chemical compound with molecular formula C18H22O8P2 and molecular weight 428.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
磷雌酚
[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)
| Molecular Formula | C18H22O8P2 |
|---|---|
| Molecular Weight | 428.08 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 428.07898 |
| Heavy Atoms | 28 |
| Complexity | 567.0 |
Chemical Identifiers
| CAS Number | 522-40-7 |
|---|---|
| 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 |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
磷雌酚 (CAS 522-40-7), with molecular formula C18H22O8P2 and molecular weight 428.08 g/mol. IUPAC: [4-[4-(4-phosphonooxyphenyl)hex-3-en-3-yl]phenyl] dihydrogen phosphate.
Chemical Property Profile of 磷雌酚
Property Insights of 磷雌酚
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 磷雌酚. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 磷雌酚. Following Lipinski's Rule of Five, 乙烯雌酚二磷酸酯 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
Frequently Asked Questions
What is the CAS number of 乙烯雌酚二磷酸酯?
The CAS number of 乙烯雌酚二磷酸酯 is 522-40-7.
What is the molecular formula of 乙烯雌酚二磷酸酯?
The molecular formula of 乙烯雌酚二磷酸酯 is C18H22O8P2.
What is the molecular weight of 乙烯雌酚二磷酸酯?
The molecular weight of 乙烯雌酚二磷酸酯 is 428.08 g/mol.
Where can I buy 乙烯雌酚二磷酸酯?
You can request a quote for 乙烯雌酚二磷酸酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 乙烯雌酚二磷酸酯?
Yes, KEHONG BIO provides custom synthesis services for 乙烯雌酚二磷酸酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.