Pyrimidine, 4,6-dichloro-2-(methylthio)-5-nitro-


Chemical Name: Pyrimidine, 4,6-dichloro-2-(methylthio)-5-nitro-
CAS Number: 1979-96-0
Product Number: AG002B5M(AGN-PC-0078L0)
Synonyms:
MDL No:
Molecular Formula: C5H3Cl2N3O2S
Molecular Weight: 240.0672

Identification/Properties


Computed Properties
Molecular Weight:
240.058g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
238.932g/mol
Monoisotopic Mass:
238.932g/mol
Topological Polar Surface Area:
96.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
191
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-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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