Benzonitrile, 5-amino-2-(4-methyl-1-piperazinyl)-


Chemical Name: Benzonitrile, 5-amino-2-(4-methyl-1-piperazinyl)-
CAS Number: 288251-82-1
Product Number: AG002WNX(AGN-PC-01KYKV)
Synonyms:
MDL No:
Molecular Formula: C12H16N4
Molecular Weight: 216.2822

Identification/Properties


Computed Properties
Molecular Weight:
216.288g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
216.137g/mol
Monoisotopic Mass:
216.137g/mol
Topological Polar Surface Area:
56.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
274
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

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NMR Spectrum


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