2,4(1H,3H)-Pyrimidinedione, 6-(chloromethyl)-


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 6-(chloromethyl)-
CAS Number: 18592-13-7
Product Number: AG003MZT(AGN-PC-0JLB0L)
Synonyms:
MDL No:
Molecular Formula: C5H5ClN2O2
Molecular Weight: 160.5584

Identification/Properties


Properties
MP:
257 °C (dec.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
160.557g/mol
XLogP3:
-0.7
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
160.004g/mol
Monoisotopic Mass:
160.004g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
212
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:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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