1-(4-methoxyphenyl)-2,4-dioxopyrimidine-5-carbonitrile


Chemical Name: 1-(4-methoxyphenyl)-2,4-dioxopyrimidine-5-carbonitrile
CAS Number: 75837-81-9
Product Number: AG005I3M(AGN-PC-0JTPTY)
Synonyms:
MDL No:
Molecular Formula: C12H9N3O3
Molecular Weight: 243.2182

Identification/Properties


Properties
MP:
315-318 °C
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
243.222g/mol
XLogP3:
0.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
243.064g/mol
Monoisotopic Mass:
243.064g/mol
Topological Polar Surface Area:
82.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
441
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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