4-Pyrimidinamine, 6-chloro-N-methyl-5-nitro-


Chemical Name: 4-Pyrimidinamine, 6-chloro-N-methyl-5-nitro-
CAS Number: 23126-82-1
Product Number: AG002M9C(AGN-PC-0KKZDK)
Synonyms:
MDL No:
Molecular Formula: C5H5ClN4O2
Molecular Weight: 188.5718

Identification/Properties


Computed Properties
Molecular Weight:
188.571g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
188.01g/mol
Monoisotopic Mass:
188.01g/mol
Topological Polar Surface Area:
83.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
173
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:
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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