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Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester
TL;DR: Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester (CAS 3309-68-0) is a chemical compound with molecular formula C8H19O2PS3 and molecular weight 274.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethoxy-(propylsulfanylmethylsulfanyl)-sulfanylidene-λ5-phosphane
Also Known As: American cyanamid 12,009, American Cyanamid-12009, ENT 22866, TM 12009, CL 12009
| Molecular Formula | C8H19O2PS3 |
|---|---|
| Molecular Weight | 274.03 g/mol |
| LogP | 4.1 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 274.02847 |
| Heavy Atoms | 14 |
| Complexity | 168.0 |
Chemical Identifiers
| CAS Number | 3309-68-0 |
|---|---|
| SMILES | CCCSCSP(=S)(OCC)OCC |
| InChIKey | QOVQEVZZHCLMPY-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester (CAS 3309-68-0), with molecular formula C8H19O2PS3 and molecular weight 274.03 g/mol. IUPAC: diethoxy-(propylsulfanylmethylsulfanyl)-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester
Property Insights of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester
The XLogP value of 4.1 indicates that Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester has 0 hydrogen bond donor(s) and 5 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, O,O-diethyl S-[(propylthio)methyl] ester?
The CAS number of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester is 3309-68-0.
What is the molecular formula of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester?
The molecular formula of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester is C8H19O2PS3.
What is the molecular weight of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester?
The molecular weight of Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester is 274.03 g/mol.
Where can I buy Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester?
You can request a quote for Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] 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, O,O-diethyl S-[(propylthio)methyl] ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, O,O-diethyl S-[(propylthio)methyl] ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.