O,O-Diethyl S-(4-nitrophenyl) phosphorothioate
TL;DR: O,O-Diethyl S-(4-nitrophenyl) phosphorothioate (CAS 3270-86-8) is a chemical compound with molecular formula C10H14NO5PS and molecular weight 291.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-diethoxyphosphorylsulfanyl-4-nitrobenzene
Also Known As: Parathion S, S-Phenyl parathion, Isoparathion, PARATHIOL, O,O-Diethyl S-(4-nitrophenyl) phosphorothioate
| Molecular Formula | C10H14NO5PS |
|---|---|
| Molecular Weight | 291.03 g/mol |
| LogP | 3.868 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 291.03302 |
| Heavy Atoms | 18 |
| Complexity | 440.08618 |
Chemical Identifiers
| CAS Number | 3270-86-8 |
|---|---|
| SMILES | CCOP(=O)(OCC)SC1=CC=C(C=C1)[N+](=O)[O-] |
Product Overview
O,O-Diethyl S-(4-nitrophenyl) phosphorothioate (CAS 3270-86-8), with molecular formula C10H14NO5PS and molecular weight 291.03 g/mol. IUPAC: 1-diethoxyphosphorylsulfanyl-4-nitrobenzene.
Chemical Property Profile of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate
Property Insights of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate
The XLogP value of 3.868 indicates that O,O-Diethyl S-(4-nitrophenyl) phosphorothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-Diethyl S-(4-nitrophenyl) phosphorothioate. Following Lipinski's Rule of Five, O,O-Diethyl S-(4-nitrophenyl) phosphorothioate has 0 hydrogen bond donor(s) and 6 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 O,O-Diethyl S-(4-nitrophenyl) phosphorothioate?
The CAS number of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate is 3270-86-8.
What is the molecular formula of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate?
The molecular formula of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate is C10H14NO5PS.
What is the molecular weight of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate?
The molecular weight of O,O-Diethyl S-(4-nitrophenyl) phosphorothioate is 291.03 g/mol.
Where can I buy O,O-Diethyl S-(4-nitrophenyl) phosphorothioate?
You can request a quote for O,O-Diethyl S-(4-nitrophenyl) phosphorothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-Diethyl S-(4-nitrophenyl) phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for O,O-Diethyl S-(4-nitrophenyl) phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.