3-Iodo-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid


Chemical Name: 3-Iodo-1H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CAS Number: 1221288-26-1
Product Number: AG0016T4(AGN-PC-0WAGCM)
Synonyms:
MDL No:
Molecular Formula: C7H4IN3O2
Molecular Weight: 289.0300

Identification/Properties


Computed Properties
Molecular Weight:
289.032g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
288.935g/mol
Monoisotopic Mass:
288.935g/mol
Topological Polar Surface Area:
78.9A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
226
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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