![2-[Bis(methylthio)methylene]malononitrile](https://resource.bocsci.com/structure/5147-80-8.gif)
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| IUPAC Name: | 2-[bis(methylsulfanyl)methylidene]propanedinitrile |
| Description: | 2-[Bis(methylthio)methylene]malononitrile (CAS# 5147-80-8) is a useful reagent for synthesis of isoxazolo[5,4-b]pyridine, pyrrolo[3,2-d]isoxazole, isoxazolo[5,4-b]-azepine-4,7-dione and isoxazole derivatives that could possess anti-cancer properties. |
| Molecular Weight: | 170.26 |
| Molecular Formula: | C6H6N2S2 |
| Canonical SMILES: | CSC(=C(C#N)C#N)SC |
| InChI: | InChI=1S/C6H6N2S2/c1-9-6(10-2)5(3-7)4-8/h1-2H3 |
| InChI Key: | FICQFRCPSFCFBY-UHFFFAOYSA-N |
| Boiling Point: | 248.3 °C at 760 mmHg |
| Melting Point: | 76-78 °C |
| Purity: | 98 % |
| Density: | 1.256 g/cm3 |
| Appearance: | Orange |
| MDL: | MFCD00052730 |
| LogP: | 1.97116 |
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