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Home > Pyridines > 1423028-53-8
1423028-53-8 | 1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-5-sulfonyl chloride
CAS No: 1423028-53-8 Catalog No: AG01A24O MDL No:MFCD22578496
Product Description
Catalog Number:
AG01A24O
Chemical Name:
1-(propan-2-yl)-1H-pyrazolo[3,4-b]pyridine-5-sulfonyl chloride
CAS Number:
1423028-53-8
Molecular Formula:
C9H10ClN3O2S
Molecular Weight:
259.7126
MDL Number:
MFCD22578496
IUPAC Name:
1-propan-2-ylpyrazolo[3,4-b]pyridine-5-sulfonyl chloride
InChI:
InChI=1S/C9H10ClN3O2S/c1-6(2)13-9-7(4-12-13)3-8(5-11-9)16(10,14)15/h3-6H,1-2H3
InChI Key:
NDVHAUPVPOLGEI-UHFFFAOYSA-N
SMILES:
CC(n1ncc2c1ncc(c2)S(=O)(=O)Cl)C
Properties
Complexity:
354
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.018g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.708g/mol
Monoisotopic Mass:
259.018g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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