4(1H)-Pyrimidinone, 2,3-dihydro-6-methyl-2-thioxo-


Chemical Name: 4(1H)-Pyrimidinone, 2,3-dihydro-6-methyl-2-thioxo-
CAS Number: 56-04-2
Product Number: AG0034DF(AGN-PC-0JUNTK)
Synonyms:
MDL No:
Molecular Formula: C5H6N2OS
Molecular Weight: 142.1789

Identification/Properties


Properties
MP:
329°C
BP:
342.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
1.6430 (estimate)
Computed Properties
Molecular Weight:
142.176g/mol
XLogP3:
-0.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
142.02g/mol
Monoisotopic Mass:
142.02g/mol
Topological Polar Surface Area:
73.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
197
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#:
3077
Hazard Statements:
H302-H351
Precautionary Statements:
P281
Class:
9
Packing Group:

NMR Spectrum


Other Analytical Data


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