Propanedinitrile, [bis(methylthio)methylene]-


Chemical Name: Propanedinitrile, [bis(methylthio)methylene]-
CAS Number: 5147-80-8
Product Number: AG00DDRP(AGN-PC-0JM3HX)
Synonyms:
MDL No:
Molecular Formula: C6H6N2S2
Molecular Weight: 170.2552

Identification/Properties


Properties
MP:
80 - 81°C
BP:
248.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
170.248g/mol
XLogP3:
1.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
169.997g/mol
Monoisotopic Mass:
169.997g/mol
Topological Polar Surface Area:
98.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
3439
Hazard Statements:
H302+H312-H315-H319-H331-H335
Precautionary Statements:
P261-P280-P305+P351+P338-P311
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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