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Methyl [(dimethoxyphosphinothioyl)thio]acetate
TL;DR: Methyl [(dimethoxyphosphinothioyl)thio]acetate (CAS 757-86-8) is a chemical compound with molecular formula C5H11O4PS2 and molecular weight 229.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-dimethoxyphosphinothioylsulfanylacetate
Also Known As: Methyl [(dimethoxyphosphinothioyl)thio]acetate, Methyl ((dimethoxyphosphinothioyl)thio)acetate, methyl 2-dimethoxyphosphinothioylsulfanylacetate, Methyl (Dimethoxyphosphinothioylthio)-Acetate, Methyl (dimethoxyphosphinothioylthio)acetate
| Molecular Formula | C5H11O4PS2 |
|---|---|
| Molecular Weight | 229.98 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 229.98364 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 757-86-8 |
|---|---|
| SMILES | COC(=O)CSP(=S)(OC)OC |
| InChIKey | PLZVCZLWZIJPPO-UHFFFAOYSA-N |
Product Overview
Methyl [(dimethoxyphosphinothioyl)thio]acetate (CAS 757-86-8), with molecular formula C5H11O4PS2 and molecular weight 229.98 g/mol. IUPAC: methyl 2-dimethoxyphosphinothioylsulfanylacetate.
Chemical Property Profile of Methyl [(dimethoxyphosphinothioyl)thio]acetate
Property Insights of Methyl [(dimethoxyphosphinothioyl)thio]acetate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl [(dimethoxyphosphinothioyl)thio]acetate. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl [(dimethoxyphosphinothioyl)thio]acetate. Following Lipinski's Rule of Five, Methyl [(dimethoxyphosphinothioyl)thio]acetate has 0 hydrogen bond donor(s) and 6 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 Methyl [(dimethoxyphosphinothioyl)thio]acetate?
The CAS number of Methyl [(dimethoxyphosphinothioyl)thio]acetate is 757-86-8.
What is the molecular formula of Methyl [(dimethoxyphosphinothioyl)thio]acetate?
The molecular formula of Methyl [(dimethoxyphosphinothioyl)thio]acetate is C5H11O4PS2.
What is the molecular weight of Methyl [(dimethoxyphosphinothioyl)thio]acetate?
The molecular weight of Methyl [(dimethoxyphosphinothioyl)thio]acetate is 229.98 g/mol.
Where can I buy Methyl [(dimethoxyphosphinothioyl)thio]acetate?
You can request a quote for Methyl [(dimethoxyphosphinothioyl)thio]acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl [(dimethoxyphosphinothioyl)thio]acetate?
Yes, KEHONG BIO provides custom synthesis services for Methyl [(dimethoxyphosphinothioyl)thio]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.