5-fluoro-2-piperazin-1-ylbenzoic acid


Chemical Name: 5-fluoro-2-piperazin-1-ylbenzoic acid
CAS Number: 1197193-39-7
Product Number: AG000PJU(AGN-PC-0BLD4K)
Synonyms:
MDL No: MFCD13191606
Molecular Formula: C11H13FN2O2
Molecular Weight: 224.2315

Identification/Properties


Computed Properties
Molecular Weight:
224.235g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
224.096g/mol
Monoisotopic Mass:
224.096g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
256
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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