Phosphorodithioic acid, O-methyl S,S-dipropyl ester
TL;DR: Phosphorodithioic acid, O-methyl S,S-dipropyl ester (CAS 4104-02-3) is a chemical compound with molecular formula C7H17O2PS2 and molecular weight 228.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[methoxy(propylsulfanyl)phosphoryl]sulfanylpropane
Also Known As: V-C Chemical V-C 3-607, Virginia-carolina VC 3-607, O-Methyl S,S-dipropyl phosphorodithioate, V-C Chemical V-C-3-607, ENT 25,821
| Molecular Formula | C7H17O2PS2 |
|---|---|
| Molecular Weight | 228.04 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 76.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 228.04076 |
| Heavy Atoms | 12 |
| Complexity | 140.0 |
Chemical Identifiers
| CAS Number | 4104-02-3 |
|---|---|
| SMILES | CCCSP(=O)(OC)SCCC |
| InChIKey | FAGCJRZVMYZXSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Phosphorodithioic acid, O-methyl S,S-dipropyl ester (CAS 4104-02-3), with molecular formula C7H17O2PS2 and molecular weight 228.04 g/mol. IUPAC: 1-[methoxy(propylsulfanyl)phosphoryl]sulfanylpropane.
Chemical Property Profile of Phosphorodithioic acid, O-methyl S,S-dipropyl ester
Property Insights of Phosphorodithioic acid, O-methyl S,S-dipropyl ester
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorodithioic acid, O-methyl S,S-dipropyl ester. The TPSA of 76.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, O-methyl S,S-dipropyl ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, O-methyl S,S-dipropyl 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, O-methyl S,S-dipropyl ester?
The CAS number of Phosphorodithioic acid, O-methyl S,S-dipropyl ester is 4104-02-3.
What is the molecular formula of Phosphorodithioic acid, O-methyl S,S-dipropyl ester?
The molecular formula of Phosphorodithioic acid, O-methyl S,S-dipropyl ester is C7H17O2PS2.
What is the molecular weight of Phosphorodithioic acid, O-methyl S,S-dipropyl ester?
The molecular weight of Phosphorodithioic acid, O-methyl S,S-dipropyl ester is 228.04 g/mol.
Where can I buy Phosphorodithioic acid, O-methyl S,S-dipropyl ester?
You can request a quote for Phosphorodithioic acid, O-methyl S,S-dipropyl 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-methyl S,S-dipropyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, O-methyl S,S-dipropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.