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Home Nitriles 2-[Di(methylthio)methylidene]malononitrile

2-[Di(methylthio)methylidene]malononitrile

CAS No.:
5147-80-8
Catalog Number:
AG00DDRP
Molecular Formula:
C6H6N2S2
Molecular Weight:
170.2552
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$19
- +
5g
98%
In Stock USA
United States
$50
- +
25g
98%
In Stock USA
United States
$200
- +
100g
98%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG00DDRP
Chemical Name:
2-[Di(methylthio)methylidene]malononitrile
CAS Number:
5147-80-8
Molecular Formula:
C6H6N2S2
Molecular Weight:
170.2552
MDL Number:
MFCD00052730
IUPAC Name:
2-[bis(methylsulfanyl)methylidene]propanedinitrile
InChI:
InChI=1S/C6H6N2S2/c1-9-6(10-2)5(3-7)4-8/h1-2H3
InChI Key:
FICQFRCPSFCFBY-UHFFFAOYSA-N
SMILES:
CSC(=C(C#N)C#N)SC
NSC Number:
202533
Properties
Complexity:
213  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.997g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
170.248g/mol
Monoisotopic Mass:
169.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
98.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Literature
Title Journal
3-Amino-5-(piperidin-1-yl)thio-phene-2,4-dicarbonitrile. Acta crystallographica. Section E, Structure reports online 20120101
Studies on the reactivity of (9-Methyl-5,6-dihydronaphtho[1â,2â:4,5]-thieno[2,3-d]pyrimidin-11-yl)hydrazine towards some reagents for biological evaluation. Scientia pharmaceutica 20100101
Regioselective synthesis of new 2-(E)-cyano(thiazolidin-2-ylidene)thiazoles. Molecules (Basel, Switzerland) 20091125
Properties