Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester
TL;DR: Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester (CAS 63869-31-8) is a chemical compound with molecular formula C11H16ClOPS3 and molecular weight 325.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-chlorophenyl)sulfanylmethylsulfanyl-ethoxy-ethyl-sulfanylidene-λ5-phosphane
Also Known As: Stauffer N-2860, ENT 25,770, N-2860, S-(((4-Chlorophenyl)thio)methyl) O-ethyl phosphonodithioate, Phosphonodithioic acid, ethyl-, S-(((4-chlorophenyl)thio)methyl) O-ethyl ester
| Molecular Formula | C11H16ClOPS3 |
|---|---|
| Molecular Weight | 325.98 g/mol |
| LogP | 5.4887 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 325.97894 |
| Heavy Atoms | 17 |
| Complexity | 382.80786 |
Chemical Identifiers
| CAS Number | 63869-31-8 |
|---|---|
| SMILES | CCOP(=S)(CC)SCSC1=CC=C(C=C1)Cl |
Product Overview
Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester (CAS 63869-31-8), with molecular formula C11H16ClOPS3 and molecular weight 325.98 g/mol. IUPAC: (4-chlorophenyl)sulfanylmethylsulfanyl-ethoxy-ethyl-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester
Property Insights of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester
The XLogP value of 5.4887 indicates that Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.23 Ų, Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester?
The CAS number of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester is 63869-31-8.
What is the molecular formula of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester?
The molecular formula of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester is C11H16ClOPS3.
What is the molecular weight of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester?
The molecular weight of Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester is 325.98 g/mol.
Where can I buy Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester?
You can request a quote for Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonodithioic acid, ethyl-, S-(((p-chlorophenyl)-thio)methyl) O-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.