| Weight | 138.17 g/mol |
|---|---|
| Formula | C7H10N2O |
| Hydrogen Acceptors | 3 |
| Hydrogen Donors | 0 |
| Aromatic Rings | 1 |
| Rotatable Bonds | 3 |
4-(1-Pyrazolyl)-2-butanone (89943-03-3)
4-(1H-pyrazol-1-yl)-2-butanone · 89943-03-3
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Predict GHS Hazards for Any Chemical in silico.
Including Acute Oral Tox, Skin Sensitization, Eye Irritation, Aquatic Tox, & more. - 4-(1H-pyrazol-1-yl)-2-butanone
- 89943-03-3
-
SMILESCC(=O)CCN1C=CC=N1
-
InChIKeyYGSSCNXKGBWTBR-UHFFFAOYSA-N
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Safety
Alternate Names
Estimated Properties
| Boiling Point | 216.11 C | EPA T.E.S.T. |
|---|---|---|
| Boiling Point | 222.52 C | EPI Suite |
| Density | 1.09 g/cm3 | EPA T.E.S.T. |
| Flash Point | 103.68 C | EPA T.E.S.T. |
| Melting Point | 40.57 C | EPI Suite |
| Water Solubility | 18245.1 mg/L | EPA T.E.S.T. |
| Water Solubility | 124850 mg/L | EPI Suite |
External Links
Synthesis
Reactant
+
dimethyl sulfide
(Corey-Kim oxidation of secondary alcohols)
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