Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester
TL;DR: Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester (CAS 27785-62-2) is a chemical compound with molecular formula C10H14ClO2PS2 and molecular weight 295.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-[ethoxy(ethylsulfanyl)phosphoryl]sulfanylbenzene
Also Known As: Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester, S-(4-Chlorophenyl) O,S-diethyl phosphorodithioate, 1-chloro-4-[ethoxy(ethylsulfanyl)phosphoryl]sulfanylbenzene, 1-chloro-4-(ethoxy-ethylsulfanyl-phosphoryl)sulfanyl-benzene
| Molecular Formula | C10H14ClO2PS2 |
|---|---|
| Molecular Weight | 295.99 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 295.98615 |
| Heavy Atoms | 16 |
| Complexity | 245.0 |
Chemical Identifiers
| CAS Number | 27785-62-2 |
|---|---|
| SMILES | CCOP(=O)(SCC)SC1=CC=C(C=C1)Cl |
| InChIKey | OJSFJYRFQOCVGU-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester (CAS 27785-62-2), with molecular formula C10H14ClO2PS2 and molecular weight 295.99 g/mol. IUPAC: 1-chloro-4-[ethoxy(ethylsulfanyl)phosphoryl]sulfanylbenzene.
Chemical Property Profile of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester
Property Insights of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester
The XLogP value of 3.2 indicates that Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester has 0 hydrogen bond donor(s) and 4 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 Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester?
The CAS number of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester is 27785-62-2.
What is the molecular formula of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester?
The molecular formula of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester is C10H14ClO2PS2.
What is the molecular weight of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester?
The molecular weight of Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester is 295.99 g/mol.
Where can I buy Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester?
You can request a quote for Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, S-(4-chlorophenyl) O,S-diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.