Phosphonodithioic acid, methyl-, O-ethyl ester
TL;DR: Phosphonodithioic acid, methyl-, O-ethyl ester (CAS 999-83-7) is a chemical compound with molecular formula C3H8OPS2- and molecular weight 154.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethoxy-methyl-sulfanylidene-sulfido-λ5-phosphane
Also Known As: O-Ethyl methylphosphonodithioate, ethoxy-methyl-sulfanylidene-sulfido-, Phosphonodithioic acid, methyl-, O-ethyl ester, methyl-phosphonodithioic acid O-ethyl ester, Ethoxy-methyl-sulfanylidene-sulfido-phosphorane
| Molecular Formula | C3H8OPS2- |
|---|---|
| Molecular Weight | 154.98 g/mol |
| LogP | 1.5091 |
| Topological Polar Surface Area | 9.23 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 154.97542 |
| Heavy Atoms | 7 |
| Complexity | 86.9357 |
Chemical Identifiers
| CAS Number | 999-83-7 |
|---|---|
| SMILES | CCOP(=S)(C)[S-] |
Product Overview
Phosphonodithioic acid, methyl-, O-ethyl ester (CAS 999-83-7), with molecular formula C3H8OPS2- and molecular weight 154.98 g/mol. IUPAC: ethoxy-methyl-sulfanylidene-sulfido-λ5-phosphane.
Chemical Property Profile of Phosphonodithioic acid, methyl-, O-ethyl ester
Property Insights of Phosphonodithioic acid, methyl-, O-ethyl ester
The XLogP value of 1.5091 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphonodithioic acid, methyl-, O-ethyl ester. With a topological polar surface area (TPSA) of 9.23 Ų, Phosphonodithioic acid, methyl-, O-ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphonodithioic acid, methyl-, O-ethyl ester has 0 hydrogen bond donor(s) and 3 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 Phosphonodithioic acid, methyl-, O-ethyl ester?
The CAS number of Phosphonodithioic acid, methyl-, O-ethyl ester is 999-83-7.
What is the molecular formula of Phosphonodithioic acid, methyl-, O-ethyl ester?
The molecular formula of Phosphonodithioic acid, methyl-, O-ethyl ester is C3H8OPS2-.
What is the molecular weight of Phosphonodithioic acid, methyl-, O-ethyl ester?
The molecular weight of Phosphonodithioic acid, methyl-, O-ethyl ester is 154.98 g/mol.
Where can I buy Phosphonodithioic acid, methyl-, O-ethyl ester?
You can request a quote for Phosphonodithioic acid, 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, methyl-, O-ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphonodithioic acid, methyl-, O-ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.