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685522-76-3 | 3-Iodo-1-methyl-1H-pyrazolo[3,4-b]pyridine
CAS No: 685522-76-3 Catalog No: AG006338 MDL No:MFCD08234758
Product Description
Catalog Number:
AG006338
Chemical Name:
3-Iodo-1-methyl-1H-pyrazolo[3,4-b]pyridine
CAS Number:
685522-76-3
Molecular Formula:
C7H6IN3
Molecular Weight:
259.0471
MDL Number:
MFCD08234758
IUPAC Name:
3-iodo-1-methylpyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C7H6IN3/c1-11-7-5(6(8)10-11)3-2-4-9-7/h2-4H,1H3
InChI Key:
SRUIXHHHURATSY-UHFFFAOYSA-N
SMILES:
Cn1nc(c2c1nccc2)I
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.961g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.05g/mol
Monoisotopic Mass:
258.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
30.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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