RefChem:316414
methyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate
Also Known As: 3-Oxa-5,7-dithia-4-phosphanonan-9-oic acid, 4-ethoxy-, methyl ester, 4-oxide|2-((Mercaptomethyl)thio)acetic acid methyl ester S-ester with diethyl phosphorothioate|Acetic acid, 2-((mercaptomethyl)thio)-, methyl ester, S-ester with diethyl phosphorothioate|methyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate|[(Diethoxyphosphinoylthio)methylthio]acetic acid methyl ester|methyl 2-({[(diethoxyphosphoryl)sulfanyl]methyl}sulfanyl)acetate|Methyl 4-ethoxy-4-oxo-3-oxa-5,7-dithia-4lambda~5~-phosphanonan-9-oate
| Molecular Formula | C8H17O5PS2 |
|---|---|
| Molecular Weight | 288.0255 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 10 |
| Exact Mass | 288.0255 |
| Monoisotopic Mass | 288.0255 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 63274-86-2 |
|---|---|
| SMILES | CCOP(=O)(OCC)SCSCC(=O)OC |
| InChIKey | BGOVSFKQTGNFLR-UHFFFAOYSA-N |
Product Overview
RefChem:316414 (CAS 63274-86-2), with molecular formula C8H17O5PS2 and molecular weight 288.0255 g/mol. IUPAC: methyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate.