2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-(chloromethyl)-


Chemical Name: 2,4(1H,3H)-Pyrimidinedione, 5-chloro-6-(chloromethyl)-
CAS Number: 73742-45-7
Product Number: AG00FACN(AGN-PC-0L6KYQ)
Synonyms:
MDL No:
Molecular Formula: C5H4Cl2N2O2
Molecular Weight: 195.0035

Identification/Properties


Computed Properties
Molecular Weight:
194.999g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
193.965g/mol
Monoisotopic Mass:
193.965g/mol
Topological Polar Surface Area:
58.2A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
249
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#:
2811
Hazard Statements:
H301-H311-H331-H341
Precautionary Statements:
P201-P202-P261-P264-P270-P271-P280-P302+P352-P304+P340-P308+P313-P310-P330-P361-P403+P233-P405-P501
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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