Benzonitrile, 4-(1-piperazinylmethyl)-


Chemical Name: Benzonitrile, 4-(1-piperazinylmethyl)-
CAS Number: 89292-70-6
Product Number: AG0040UO(AGN-PC-0KBOPM)
Synonyms:
MDL No:
Molecular Formula: C12H15N3
Molecular Weight: 201.2676

Identification/Properties


Properties
BP:
348.9±32.0 °C(Predicted)
Computed Properties
Molecular Weight:
201.273g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
201.127g/mol
Monoisotopic Mass:
201.127g/mol
Topological Polar Surface Area:
39.1A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
229
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


NMR Spectrum


Other Analytical Data


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