Phosphonothioic difluoride, phenyl-
TL;DR: Phosphonothioic difluoride, phenyl- (CAS 657-40-9) is a chemical compound with molecular formula C6H5F2PS and molecular weight 177.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
difluoro-phenyl-sulfanylidene-λ5-phosphane
Also Known As: Phosphonothioic difluoride, phenyl-, Phenylphosphonothioic difluoride, difluoro-phenyl-sulfanylidene-, Phenyldifluorophosphine sulfide, Phosphonothioic difluoride,phenyl
| Molecular Formula | C6H5F2PS |
|---|---|
| Molecular Weight | 177.98 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 32.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 177.98177 |
| Heavy Atoms | 10 |
| Complexity | 148.0 |
Chemical Identifiers
| CAS Number | 657-40-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)P(=S)(F)F |
| InChIKey | HNIMECYZAFNCNB-UHFFFAOYSA-N |
Product Overview
Phosphonothioic difluoride, phenyl- (CAS 657-40-9), with molecular formula C6H5F2PS and molecular weight 177.98 g/mol. IUPAC: difluoro-phenyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic difluoride, phenyl-
Property Insights of Phosphonothioic difluoride, phenyl-
The XLogP value of 3.7 indicates that Phosphonothioic difluoride, phenyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.1 Ų, Phosphonothioic difluoride, phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonothioic difluoride, phenyl- 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 Phosphonothioic difluoride, phenyl-?
The CAS number of Phosphonothioic difluoride, phenyl- is 657-40-9.
What is the molecular formula of Phosphonothioic difluoride, phenyl-?
The molecular formula of Phosphonothioic difluoride, phenyl- is C6H5F2PS.
What is the molecular weight of Phosphonothioic difluoride, phenyl-?
The molecular weight of Phosphonothioic difluoride, phenyl- is 177.98 g/mol.
Where can I buy Phosphonothioic difluoride, phenyl-?
You can request a quote for Phosphonothioic difluoride, phenyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic difluoride, phenyl-?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic difluoride, phenyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.