Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester
TL;DR: Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester (CAS 1085-34-3) is a chemical compound with molecular formula C10H14NO4PS and molecular weight 275.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl-(4-nitrophenoxy)-propoxy-sulfanylidene-λ5-phosphane
Also Known As: Monsanto CP-40273, CP 40273, ENT 25,786, AI3-25786, o-(4-nitrophenyl) o-propyl methylphosphonothioate
| Molecular Formula | C10H14NO4PS |
|---|---|
| Molecular Weight | 275.04 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 96.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.03812 |
| Heavy Atoms | 17 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 1085-34-3 |
|---|---|
| SMILES | CCCOP(=S)(C)OC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | CUONSTMEQBVTLL-UHFFFAOYSA-N |
Product Overview
Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester (CAS 1085-34-3), with molecular formula C10H14NO4PS and molecular weight 275.04 g/mol. IUPAC: methyl-(4-nitrophenoxy)-propoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester
Property Insights of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester
The XLogP value of 3.9 indicates that Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester 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 Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester. Following Lipinski's Rule of Five, Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl 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, methyl-, O-(p-nitrophenyl) O-propyl ester?
The CAS number of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester is 1085-34-3.
What is the molecular formula of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester?
The molecular formula of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester is C10H14NO4PS.
What is the molecular weight of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester?
The molecular weight of Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester is 275.04 g/mol.
Where can I buy Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester?
You can request a quote for Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl 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, methyl-, O-(p-nitrophenyl) O-propyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonothioic acid, methyl-, O-(p-nitrophenyl) O-propyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.