1-Boc-3-bromo-1H-pyrazolo[3,4-b]pyridine


Chemical Name: 1-Boc-3-bromo-1H-pyrazolo[3,4-b]pyridine
CAS Number: 1234616-46-6
Product Number: AG000KNG(AGN-PC-0WA4CO)
Synonyms:
MDL No:
Molecular Formula: C11H12BrN3O2
Molecular Weight: 298.1359

Identification/Properties


Computed Properties
Molecular Weight:
298.14g/mol
XLogP3:
3.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
297.011g/mol
Monoisotopic Mass:
297.011g/mol
Topological Polar Surface Area:
57A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
306
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:
Warning
UN#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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