Benzonitrile, 4-[(4-methyl-1-piperazinyl)methyl]-


Chemical Name: Benzonitrile, 4-[(4-methyl-1-piperazinyl)methyl]-
CAS Number: 125743-63-7
Product Number: AG000OLT(AGN-PC-0M0OPZ)
Synonyms:
MDL No:
Molecular Formula: C13H17N3
Molecular Weight: 215.2942

Identification/Properties


Computed Properties
Molecular Weight:
215.3g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
215.142g/mol
Monoisotopic Mass:
215.142g/mol
Topological Polar Surface Area:
30.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
252
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:
Danger
UN#:
1759
Hazard Statements:
H302-H312-H314-H332
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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