1H-Pyrazolo[3,4-b]pyridine, 4-iodo-


Chemical Name: 1H-Pyrazolo[3,4-b]pyridine, 4-iodo-
CAS Number: 861881-02-9
Product Number: AG004SW2(AGN-PC-0BXYIA)
Synonyms:
MDL No:
Molecular Formula: C6H4IN3
Molecular Weight: 245.0205

Identification/Properties


Properties
BP:
379.8±22.0 °C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
245.023g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
244.945g/mol
Monoisotopic Mass:
244.945g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
130
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#:
N/A
Hazard Statements:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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