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1256826-72-8 | 1H-Pyrazolo[3,4-b]pyridine, 6-chloro-3-methyl-
CAS No: 1256826-72-8 Catalog No: AG000OGN MDL No:MFCD18256943
Product Description
Catalog Number:
AG000OGN
Chemical Name:
1H-Pyrazolo[3,4-b]pyridine, 6-chloro-3-methyl-
CAS Number:
1256826-72-8
Molecular Formula:
C7H6ClN3
Molecular Weight:
167.5956
MDL Number:
MFCD18256943
IUPAC Name:
6-chloro-3-methyl-2H-pyrazolo[3,4-b]pyridine
InChI:
InChI=1S/C7H6ClN3/c1-4-5-2-3-6(8)9-7(5)11-10-4/h2-3H,1H3,(H,9,10,11)
InChI Key:
OBNHCZMUCHGNBW-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)[nH]nc2C
Properties
Complexity:
153
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
167.025g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
167.596g/mol
Monoisotopic Mass:
167.025g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
41.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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