Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester
TL;DR: Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester (CAS 86889-58-9) is a chemical compound with molecular formula C14H15O4PS2 and molecular weight 342.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methoxy-(4-methylsulfonylphenoxy)-phenyl-sulfanylidene-λ5-phosphane
Also Known As: Phenylphosphonothioic acid O-methyl O-(p-(methylsulfonyl)phenyl) ester, O-Methyl O-(p-(methylsulfonyl)phenyl) phenylphosphonothioate, Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester, methoxy-(4-methylsulfonylphenoxy)-phenyl-sulfanylidene-, O-[4-(Methanesulfonyl)phenyl] O-methyl phenylphosphonothioate
| Molecular Formula | C14H15O4PS2 |
|---|---|
| Molecular Weight | 342.01 g/mol |
| LogP | 3.8 |
| Topological Polar Surface Area | 93.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 342.01492 |
| Heavy Atoms | 21 |
| Complexity | 472.0 |
Chemical Identifiers
| CAS Number | 86889-58-9 |
|---|---|
| SMILES | COP(=S)(C1=CC=CC=C1)OC2=CC=C(C=C2)S(=O)(=O)C |
| InChIKey | WUPOBAMMIUNUNI-UHFFFAOYSA-N |
Product Overview
Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester (CAS 86889-58-9), with molecular formula C14H15O4PS2 and molecular weight 342.01 g/mol. IUPAC: methoxy-(4-methylsulfonylphenoxy)-phenyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester
Property Insights of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester
The XLogP value of 3.8 indicates that Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester. Following Lipinski's Rule of Five, Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester has 0 hydrogen bond donor(s) and 5 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 acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester?
The CAS number of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester is 86889-58-9.
What is the molecular formula of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester?
The molecular formula of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester is C14H15O4PS2.
What is the molecular weight of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester?
The molecular weight of Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester is 342.01 g/mol.
Where can I buy Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester?
You can request a quote for Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, phenyl-, O-methyl O-(p-(methylsulfonyl)phenyl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.