RefChem:371265
3-(diethoxyphosphorylsulfanylmethyl)-5-methyl-1,3,4-oxadiazol-2-one
Also Known As: Phosphorothioic acid, O,O-diethyl ester, S-ester with 3-(mercaptomethyl)-5-methyl-1,3,4-oxadiazol-2(3H)-one|3-(diethoxyphosphorylsulfanylmethyl)-5-methyl-1,3,4-oxadiazol-2-one|O,O-diethyl S-[(5-methyl-2-oxo-1,3,4-oxadiazol-3(2H)-yl)methyl] phosphorothioate
CAS: 2544-52-7
| Molecular Formula | C8H15N2O5PS |
|---|---|
| Molecular Weight | 282.0439 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 103.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 282.0439 |
| Monoisotopic Mass | 282.0439 |
| Heavy Atoms | 17 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 2544-52-7 |
|---|---|
| SMILES | CCOP(=O)(OCC)SCN1C(=O)OC(=N1)C |
| InChIKey | BMGRCCNWEFPJON-UHFFFAOYSA-N |
Product Overview
RefChem:371265 (CAS 2544-52-7), with molecular formula C8H15N2O5PS and molecular weight 282.0439 g/mol. IUPAC: 3-(diethoxyphosphorylsulfanylmethyl)-5-methyl-1,3,4-oxadiazol-2-one.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
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