4-amino-6-chloro-2-methylpyrimidine-5-carbonitrile


Chemical Name: 4-amino-6-chloro-2-methylpyrimidine-5-carbonitrile
CAS Number: 76574-37-3
Product Number: AG003KQA(AGN-PC-0ALILU)
Synonyms:
MDL No: MFCD07761831
Molecular Formula: C6H5ClN4
Molecular Weight: 168.5837

Identification/Properties


Properties
MP:
245-246℃(Solv: ethanol, 75% (64-17-5))
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
168.58g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
168.020274g/mol
Monoisotopic Mass:
168.020274g/mol
Topological Polar Surface Area:
75.6Ų
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
186
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:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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