tert-butyl 4-(4-bromopyrazol-1-yl)piperidine-1-carboxylate


Chemical Name: tert-butyl 4-(4-bromopyrazol-1-yl)piperidine-1-carboxylate
CAS Number: 877399-50-3
Product Number: AG008DC2(AGN-PC-07CN5N)
Synonyms:
MDL No:
Molecular Formula: C13H20BrN3O2
Molecular Weight: 330.2208

Identification/Properties


Computed Properties
Molecular Weight:
330.226g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
329.074g/mol
Monoisotopic Mass:
329.074g/mol
Topological Polar Surface Area:
47.4A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
324
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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