Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester
TL;DR: Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester (CAS 122861-99-8) is a chemical compound with molecular formula C15H16NO5PS and molecular weight 353.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxy-methoxy-[4-(4-nitrophenyl)phenoxy]-sulfanylidene-λ5-phosphane
Also Known As: ethoxy-methoxy-[4-(4-nitrophenyl)phenoxy]-sulfanylidene-, Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester, Ethoxy-methoxy-[4-(4-nitrophenyl)phenoxy]-sulfanylidene-phosphorane, O-Ethyl O-methyl O-(4'-nitro[1,1'-biphenyl]-4-yl) phosphorothioate
| Molecular Formula | C15H16NO5PS |
|---|---|
| Molecular Weight | 353.05 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 353.04868 |
| Heavy Atoms | 23 |
| Complexity | 428.0 |
Chemical Identifiers
| CAS Number | 122861-99-8 |
|---|---|
| SMILES | CCOP(=S)(OC)OC1=CC=C(C=C1)C2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | JFTFDMPKABNENT-UHFFFAOYSA-N |
Product Overview
Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester (CAS 122861-99-8), with molecular formula C15H16NO5PS and molecular weight 353.05 g/mol. IUPAC: ethoxy-methoxy-[4-(4-nitrophenyl)phenoxy]-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester
Property Insights of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester
The XLogP value of 5.1 indicates that Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester. Following Lipinski's Rule of Five, Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester?
The CAS number of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester is 122861-99-8.
What is the molecular formula of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester?
The molecular formula of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester is C15H16NO5PS.
What is the molecular weight of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester?
The molecular weight of Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester is 353.05 g/mol.
Where can I buy Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester?
You can request a quote for Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O-ethyl O-methyl O-(4'-nitro(1,1'-biphenyl)-4-yl) ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.