1,2,4-Triazine-5,6-dione, tetrahydro-2-methyl-3-thioxo-


Chemical Name: 1,2,4-Triazine-5,6-dione, tetrahydro-2-methyl-3-thioxo-
CAS Number: 58909-39-0
Product Number: AG003UOU(AGN-PC-0KO70C)
Synonyms:
MDL No:
Molecular Formula: C4H5N3O2S
Molecular Weight: 159.1664

Identification/Properties


Properties
MP:
168-171 °C(lit.)
BP:
272.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
159.163g/mol
XLogP3:
-0.4
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
159.01g/mol
Monoisotopic Mass:
159.01g/mol
Topological Polar Surface Area:
93.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
215
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


NMR Spectrum


Other Analytical Data


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