Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane
TL;DR: Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane (CAS 18302-96-0) is a chemical compound with molecular formula C9H12NO4PS and molecular weight 261.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane
Also Known As: ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-, J1.732.566C, O-Ethyl O-(4-nitrophenyl) methylphosphonothioate, ETHOXY-METHYL-(4-NITROPHENOXY)-SULFANYLIDENE-PHOSPHORANE, O-ETHYL O-4-NITROPHENYL METHYLPHOSPHONOTHIOATE
| Molecular Formula | C9H12NO4PS |
|---|---|
| Molecular Weight | 261.02 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 261.02246 |
| Heavy Atoms | 16 |
| Complexity | 286.0 |
Chemical Identifiers
| CAS Number | 18302-96-0 |
|---|---|
| SMILES | CCOP(=S)(C)OC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | VYHFGLKCTXBPPZ-UHFFFAOYSA-N |
Product Overview
Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane (CAS 18302-96-0), with molecular formula C9H12NO4PS and molecular weight 261.02 g/mol. IUPAC: ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane
Property Insights of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane
The XLogP value of 3.4 indicates that Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane. Following Lipinski's Rule of Five, Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane 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 Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane?
The CAS number of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane is 18302-96-0.
What is the molecular formula of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane?
The molecular formula of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane is C9H12NO4PS.
What is the molecular weight of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane?
The molecular weight of Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane is 261.02 g/mol.
Where can I buy Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane?
You can request a quote for Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane?
Yes, KEHONG BIO provides custom synthesis services for Ethoxy-methyl-(4-nitrophenoxy)-sulfanylidene-phosphorane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.