2(1H)-Pyrazinethione


Chemical Name: 2(1H)-Pyrazinethione
CAS Number: 38521-06-1
Product Number: AG003HIF(AGN-PC-0KZ2AT)
Synonyms:
MDL No:
Molecular Formula: C4H4N2S
Molecular Weight: 112.1530

Identification/Properties


Properties
MP:
207-213℃
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
112.15g/mol
XLogP3:
-0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
112.01g/mol
Monoisotopic Mass:
112.01g/mol
Topological Polar Surface Area:
56.5A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
137
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#:
1760
Hazard Statements:
H302-H315-H318-H335
Precautionary Statements:
P280-P301+P312+P330-P305+P351+P338+P310
Class:
8
Packing Group:

NMR Spectrum


PNMR/2-MERCAPTOPYRAZINE-38521-06-1-hnmr.pdf

Other Analytical Data


POTHER/2-MERCAPTOPYRAZINE-38521-06-1-hplc.PDF

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