2,4(1H,3H)-Pyrimidinedione, 5-[(1E)-2-bromoethenyl]-


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 5-[(1E)-2-bromoethenyl]-
CAS Number: 69304-49-0
Product Number: AG003C0T(AGN-PC-0OGQRG)
Synonyms:
MDL No:
Molecular Formula: C6H5BrN2O2
Molecular Weight: 217.0201

Identification/Properties


Properties
MP:
189-194 °C (dec.)(lit.)
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
217.022g/mol
XLogP3:
0.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
215.953g/mol
Monoisotopic Mass:
215.953g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
257
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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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