RefChem:316411
ethyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate
Also Known As: Acetic acid, ((((diethoxyphosphinyl)thio)methyl)thio)-, ethyl ester|2-((Mercaptomethyl)thio)acetic acid ethyl ester S-ester with diethyl phosphorothioate|Acetic acid, 2-((mercaptomethyl)thio)-, ethyl ester, S-ester with diethyl phosphorothioate|ethyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate|[(Diethoxyphosphinoylthio)methylthio]acetic acid ethyl ester|ethyl 2-({[(diethoxyphosphoryl)sulfanyl]methyl}sulfanyl)acetate|Ethyl 4-ethoxy-4-oxo-3-oxa-5,7-dithia-4lambda~5~-phosphanonan-9-oate
| Molecular Formula | C9H19O5PS2 |
|---|---|
| Molecular Weight | 302.04117 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 112.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 11 |
| Exact Mass | 302.04117 |
| Monoisotopic Mass | 302.04117 |
| Heavy Atoms | 17 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 68640-58-4 |
|---|---|
| SMILES | CCOC(=O)CSCSP(=O)(OCC)OCC |
| InChIKey | XGZNJXJOSSUDID-UHFFFAOYSA-N |
Product Overview
RefChem:316411 (CAS 68640-58-4), with molecular formula C9H19O5PS2 and molecular weight 302.04117 g/mol. IUPAC: ethyl 2-(diethoxyphosphorylsulfanylmethylsulfanyl)acetate.
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