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5147-80-8

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5147-80-8 Structure

5147-80-8 Structure

Identification	Back Directory
[Name] 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE
[CAS] 5147-80-8
[Synonyms] NSC 202533 AKOS UB-20051 [Bis(methylthio)m [Bis(Methylthio)Methylene]Malo 1,1-Dicyano-2,2-bis(methylthio)ethene 1,1-Dicyano-2,2-bis(methylthio)ethylene [BIS(METHYLTHIO)METHYLENE]MALONONITRILE 3,3-Di(methylthio)-2-cyanoacrylonitrile 2-Cyano-3,3-bis(methylthio)acrylonitrile 3,3-BIS(METHYLTHIO)-2-CYANOACRYLONITRILE 2-[Di(Methylthio)Methylene]Malononitrile 2-(bis(methylthio)methylene)malononitrile [2-Cyano-3,3-di(methylthio)]acrylonitrile [BIS(METHYLTHIO)METHYLENE]PROPANEDINITRILE 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE 2-[Bis(methylthio)methylidene]malononitrile 2-[Bis(methylthio)methylene]propanedinitrile 2-[Bis(methylthio)methylene]malononitrile 97% Propanedinitrile,2-[bis(methylthio)methylene]- 2,2-Bis(methylthio)-1,1-ethylenedicarbonitrile 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE,98+% 2-[Bis(methylsulfanyl)methylene]propanedinitrile [Bis(methylsulphanyl)methylidene]propane-1,3-dinitrile, [Bis(methylmercapto)methylidene]propane-1,3-dinitrile
[Molecular Formula] C6H6N2S2
[MDL Number] MFCD00052730
[MOL File] 5147-80-8.mol
[Molecular Weight] 170.26

Chemical Properties	Back Directory
[Melting point ] 76-78°C
[Boiling point ] 248.3±40.0 °C(Predicted)
[density ] 1.256±0.06 g/cm3(Predicted)
[storage temp. ] 2-8°C
[solubility ] DMSO (Slightly), Methanol (Slightly)
[form ] solid
[color ] off-white
[InChI] 1S/C6H6N2S2/c1-9-6(10-2)5(3-7)4-8/h1-2H3
[InChIKey] FICQFRCPSFCFBY-UHFFFAOYSA-N
[SMILES] CS\C(SC)=C(\C#N)C#N
[EPA Substance Registry System] Propanedinitrile, [bis(methylthio)methylene]- (5147-80-8)

Safety Data	Back Directory
[Symbol(GHS) ] GHS06,GHS07
[Signal word ] Warning
[Hazard statements ] H302-H312-H315-H319-H331-H335
[Precautionary statements ] P261-P280-P304+P340-P305+P351+P338-P405-P501a
[Hazard Codes ] T,Xi,Xn
[Risk Statements ] 20/21/22-36/37/38-22
[Safety Statements ] 26-36/37/39
[RIDADR ] 3439
[WGK Germany ] 3
[Hazard Note ] Toxic
[HazardClass ] 6.1
[HazardClass ] IRRITANT
[HS Code ] 2930909899
[Storage Class] 11 - Combustible Solids
[Hazard Classifications] Acute Tox. 4 Oral

Hazard Information	Back Directory
[Uses] 2-[Bis(methylthio)methylene]malononitrile is used as pharmaceutical intermediate.

Spectrum Detail	Back Directory
[Spectrum Detail] 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE(5147-80-8)MS 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE(5147-80-8)¹HNMR 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE(5147-80-8)IR1 2-[DI(METHYLTHIO)METHYLIDENE]MALONONITRILE(5147-80-8)IR2

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