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Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate
TL;DR: Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate (CAS 7501-96-4) is a chemical compound with molecular formula C17H19O4PS2 and molecular weight 382.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate
Also Known As: ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate, ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]su, S-Ethoxycarbonyl O-(3-methylphenyl) O-(4-methylphenyl) phosphorodithioate
| Molecular Formula | C17H19O4PS2 |
|---|---|
| Molecular Weight | 382.05 g/mol |
| LogP | 6.5 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 382.04623 |
| Heavy Atoms | 24 |
| Complexity | 452.0 |
Chemical Identifiers
| CAS Number | 7501-96-4 |
|---|---|
| SMILES | CCOC(=O)SP(=S)(OC1=CC=C(C=C1)C)OC2=CC=CC(=C2)C |
| InChIKey | OQKDRGDXEBLWAF-UHFFFAOYSA-N |
Product Overview
Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate (CAS 7501-96-4), with molecular formula C17H19O4PS2 and molecular weight 382.05 g/mol. IUPAC: ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate.
Chemical Property Profile of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate
Property Insights of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate
The XLogP value of 6.5 indicates that Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate. Following Lipinski's Rule of Five, Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate 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 Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate?
The CAS number of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate is 7501-96-4.
What is the molecular formula of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate?
The molecular formula of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate is C17H19O4PS2.
What is the molecular weight of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate?
The molecular weight of Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate is 382.05 g/mol.
Where can I buy Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate?
You can request a quote for Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl [(3-methylphenoxy)-(4-methylphenoxy)phosphinothioyl]sulfanylformate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.