Diphenyl phosphorofluoridate
TL;DR: Diphenyl phosphorofluoridate (CAS 4059-09-0) is a chemical compound with molecular formula C12H10FO3P and molecular weight 252.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[fluoro(phenoxy)phosphoryl]oxybenzene
Also Known As: diphenyl phosphorofluoridate, [fluoro(phenoxy)phosphoryl]oxybenzene, Fluorophosphonic acid diphenyl ester, (Fluoro-phenoxy-phosphoryl)oxybenzene, Fluoridophosphoric acid diphenyl ester
| Molecular Formula | C12H10FO3P |
|---|---|
| Molecular Weight | 252.04 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 35.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 252.03516 |
| Heavy Atoms | 17 |
| Complexity | 249.0 |
Chemical Identifiers
| CAS Number | 4059-09-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)OP(=O)(OC2=CC=CC=C2)F |
| InChIKey | XFKSLARHPIQBFF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diphenyl phosphorofluoridate (CAS 4059-09-0), with molecular formula C12H10FO3P and molecular weight 252.04 g/mol. IUPAC: [fluoro(phenoxy)phosphoryl]oxybenzene.
Chemical Property Profile of Diphenyl phosphorofluoridate
Property Insights of Diphenyl phosphorofluoridate
The XLogP value of 3.3 indicates that Diphenyl phosphorofluoridate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.5 Ų, Diphenyl phosphorofluoridate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diphenyl phosphorofluoridate has 0 hydrogen bond donor(s) and 4 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 Diphenyl phosphorofluoridate?
The CAS number of Diphenyl phosphorofluoridate is 4059-09-0.
What is the molecular formula of Diphenyl phosphorofluoridate?
The molecular formula of Diphenyl phosphorofluoridate is C12H10FO3P.
What is the molecular weight of Diphenyl phosphorofluoridate?
The molecular weight of Diphenyl phosphorofluoridate is 252.04 g/mol.
Where can I buy Diphenyl phosphorofluoridate?
You can request a quote for Diphenyl phosphorofluoridate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diphenyl phosphorofluoridate?
Yes, KEHONG BIO provides custom synthesis services for Diphenyl phosphorofluoridate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.