| Weight | 182.288 g/mol |
|---|---|
| Formula | C10H14OS |
| Hydrogen Acceptors | 2 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 3 |
1-(2,5-dimethyl-3-thienyl)butan-1-one (500891-66-7)
500891-66-7
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 500891-66-7
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SMILESCCCC(=O)C1=C(SC(=C1)C)C
-
InChIKeyMCYYNHOPHDOATQ-UHFFFAOYSA-N
Suppliers
Safety
Alternate Names
Estimated Properties
| Boiling Point | 255.51 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 272.19 C | EPI Suite |
| Density | 1.09 g/cm3 | EPA T.E.S.T. |
| Flash Point | 99.13 C | EPA T.E.S.T. |
| Melting Point | 67.15 C | EPI Suite |
| Water Solubility | 367.02 mg/L | EPA T.E.S.T. |
| Water Solubility | 174.77 mg/L | EPI Suite |
External Links
Synthesis
Reactant
+
dimethyl sulfide
(Corey-Kim oxidation of secondary alcohols)
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4,5-dimethylthiophene-3-carbohydrazide
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1-(2,5-dimethyl-3-thienyl)butan-1-one
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