Home Carboxys 3-Iodo-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid

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

CAS No.:
1221288-26-1
Catalog Number:
AG0016T4
Molecular Formula:
C7H4IN3O2
Molecular Weight:
289.0300
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Product Description
Catalog Number:
AG0016T4
Chemical Name:
3-Iodo-1h-pyrazolo[3,4-b]pyridine-5-carboxylic acid
CAS Number:
1221288-26-1
Molecular Formula:
C7H4IN3O2
Molecular Weight:
289.0300
MDL Number:
MFCD17015946
IUPAC Name:
3-iodo-2H-pyrazolo[3,4-b]pyridine-5-carboxylic acid
InChI:
InChI=1S/C7H4IN3O2/c8-5-4-1-3(7(12)13)2-9-6(4)11-10-5/h1-2H,(H,12,13)(H,9,10,11)
InChI Key:
CUTUNPSLNLUDSY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cc2c(I)n[nH]c2nc1
Properties
Complexity:
226  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
288.935g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
289.032g/mol
Monoisotopic Mass:
288.935g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties