2,4(1H,3H)-Pyrimidinedione, 5-chloro-


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 5-chloro-
CAS Number: 1820-81-1
Product Number: AG00239S(AGN-PC-0BSKC0)
Synonyms:
MDL No:
Molecular Formula: C4H3ClN2O2
Molecular Weight: 146.5318

Identification/Properties


Properties
MP:
>300 °C
BP:
413.6 °C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.6550 (estimate)
Solubility:
1 M NH4OH: soluble50mg/mL
Computed Properties
Molecular Weight:
146.53g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
145.988g/mol
Monoisotopic Mass:
145.988g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
9
Formal Charge:
0
Complexity:
199
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#:
N/A
Hazard Statements:
H302-H315-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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