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1630907-17-3 | 3-Iodo-5-methyl-1H-pyrazolo[3,4-b]pyridine
CAS No: 1630907-17-3 Catalog No: AG00HYUF MDL No:MFCD28501428
Product Description
Catalog Number:
AG00HYUF
Chemical Name:
3-Iodo-5-methyl-1H-pyrazolo[3,4-b]pyridine
CAS Number:
1630907-17-3
Molecular Formula:
C7H6IN3
Molecular Weight:
259.0471
MDL Number:
MFCD28501428
IUPAC Name:
3-iodo-5-methyl-2H-pyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C7H6IN3/c1-4-2-5-6(8)10-11-7(5)9-3-4/h2-3H,1H3,(H,9,10,11)
InChI Key:
ZJTKAEQZCZQFBW-UHFFFAOYSA-N
SMILES:
Cc1cnc2c(c1)c(I)n[nH]2
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:
1
Isotope Atom Count:
0
Molecular Weight:
259.05g/mol
Monoisotopic Mass:
258.961g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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