1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene
TL;DR: 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene (CAS 210486-74-1) is a chemical compound with molecular formula C12H15F2O3P and molecular weight 276.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene
Also Known As: diethyl (Z)-(1-fluoro-2-(4-fluorophenyl)vinyl)phosphonate, Diethyl 1-fluoro-2-(4-fluorophenyl)vinylphosphonate, 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene, [(E)-alpha,4-Difluorostyryl]phosphonic acid diethyl ester, 1-[(E)-2-diethoxyphosphoryl-2-fluoro-vinyl]-4-fluoro-benzene
| Molecular Formula | C12H15F2O3P |
|---|---|
| Molecular Weight | 276.07 g/mol |
| LogP | 4.3597 |
| Topological Polar Surface Area | 35.53 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 276.0727 |
| Heavy Atoms | 18 |
| Complexity | 446.89526 |
Chemical Identifiers
| CAS Number | 210486-74-1 |
|---|---|
| SMILES | CCOP(=O)(/C(=C/C1=CC=C(C=C1)F)/F)OCC |
Product Overview
1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene (CAS 210486-74-1), with molecular formula C12H15F2O3P and molecular weight 276.07 g/mol. IUPAC: 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene.
Chemical Property Profile of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene
Property Insights of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene
The XLogP value of 4.3597 indicates that 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.53 Ų, 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene has 0 hydrogen bond donor(s) and 3 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 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene?
The CAS number of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene is 210486-74-1.
What is the molecular formula of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene?
The molecular formula of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene is C12H15F2O3P.
What is the molecular weight of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene?
The molecular weight of 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene is 276.07 g/mol.
Where can I buy 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene?
You can request a quote for 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[(E)-2-diethoxyphosphoryl-2-fluoroethenyl]-4-fluorobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.