RefChem:371299
TL;DR: RefChem:371299 (CAS 8003-98-3) is a chemical compound with molecular formula C18H24N2O10P2S2 and molecular weight 554.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane;dimethoxy-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane
Also Known As: diethoxy-(4-nitrophenoxy)-sulfanylidene-, Phosphorothioic acid, O,O-diethyl O-(p-nitrophenyl) ester mixed with phosphorothioic acid, O,O-dimethyl O-(p-nitrophenyl) ester, Diethoxy-(4-nitrophenoxy)-sulfanylidene-lambda5-phosphane;dimethoxy-(4-nitrophenoxy)-sulfanylidene-lambda5-phosphane, o,o-diethyl o-(4-nitrophenyl)phosphorothioate- o,o-dimethyl o-(4-nitrophenyl) phosphorothioate(1:1), E5-phosphane,dimethoxy-(4-nitrophenoxy)-sulfanylidene-
| Molecular Formula | C18H24N2O10P2S2 |
|---|---|
| Molecular Weight | 554.03 g/mol |
| LogP | 5.76 |
| Topological Polar Surface Area | 211.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 10 |
| Exact Mass | 554.0348 |
| Heavy Atoms | 34 |
| Complexity | 583.0 |
Chemical Identifiers
| CAS Number | 8003-98-3 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=CC=C(C=C1)[N+](=O)[O-].COP(=S)(OC)OC1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | IMUWOGWSYBMRIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
RefChem:371299 (CAS 8003-98-3), with molecular formula C18H24N2O10P2S2 and molecular weight 554.03 g/mol. IUPAC: diethoxy-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane;dimethoxy-(4-nitrophenoxy)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of RefChem:371299
Property Insights of RefChem:371299
The XLogP value of 5.76 indicates that RefChem:371299 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 211.0 Ų indicates high polarity, suggesting RefChem:371299 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, RefChem:371299 has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:371299?
The CAS number of RefChem:371299 is 8003-98-3.
What is the molecular formula of RefChem:371299?
The molecular formula of RefChem:371299 is C18H24N2O10P2S2.
What is the molecular weight of RefChem:371299?
The molecular weight of RefChem:371299 is 554.03 g/mol.
Where can I buy RefChem:371299?
You can request a quote for RefChem:371299 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:371299?
Yes, KEHONG BIO provides custom synthesis services for RefChem:371299 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.